data_2dq5_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 2dq5 _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 ' 174' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 C--O 1.231 0.086 0 CA-C-O 119.344 -0.36 . . . . 72.42 110.873 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.2 161.09 29.66 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.438 1.086 . . . . 60.45 108.334 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 1.1 mp -74.1 -47.95 32.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.057 -0.974 . . . . 74.03 110.943 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.15 -36.02 23.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 75.15 110.902 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 49.4 m80 -93.97 104.5 16.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.132 -0.485 . . . . 75.03 110.888 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.62 -32.83 25.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 72.34 110.869 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -94.95 34.71 1.33 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 62.01 110.845 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -155.71 113.08 3.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 63.42 110.885 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.17 153.28 36.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 74.04 110.943 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 12.7 m -53.59 174.52 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 72.4 111.14 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 55.5 t-20 -132.83 -40.86 0.94 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 73.4 110.928 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.1 -170.12 2.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 74.21 110.9 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -119.61 123.75 44.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 75.25 110.939 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.44 108.49 14.11 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.489 1.118 . . . . 55.33 108.35 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 65.7 t -73.81 -26.79 21.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.013 -0.994 . . . . 74.24 111.123 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.63 -56.73 16.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.193 -0.458 . . . . 75.33 111.181 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -89.91 -12.45 38.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.197 -0.456 . . . . 55.21 110.866 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 5.5 t0 64.33 58.67 1.08 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.209 -0.451 . . . . 75.31 110.944 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -162.52 124.39 2.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 73.51 110.92 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.81 149.33 6.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.174 -0.466 . . . . 73.33 110.896 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -147.87 -178.87 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 71.11 111.192 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 20.4 p -125.7 -175.29 3.3 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.549 1.156 . . . . 74.2 108.308 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -73.15 -35.84 66.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.013 -0.994 . . . . 72.21 111.064 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.67 -24.16 67.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.192 -0.458 . . . . 74.23 110.894 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 30.1 m -81.17 -34.87 32.09 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.558 1.161 . . . . 74.51 108.353 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 28.3 mtmt -76.89 -14.86 59.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.036 -0.983 . . . . 74.33 110.957 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 5.7 tp -105.35 -44.86 4.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 72.13 110.922 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 47.2 t -89.73 -42.8 14.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.2 -0.455 . . . . 72.33 111.12 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -74.89 -142.33 0.84 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.79 -0.719 . . . . 74.42 112.48 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -129.08 23.95 5.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.855 0.359 . . . . 74.51 110.859 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -95.65 37.35 1.21 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 63.22 110.876 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 10.5 ptt-85 -94.31 -32.7 13.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 74.24 110.872 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -105.03 7.23 33.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 71.15 110.844 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 51.0 m170 -79.68 174.92 11.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 65.14 110.885 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -99.23 144.46 28.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 74.34 110.961 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 34.0 m -146.21 -175.88 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.25 -0.432 . . . . 63.43 111.14 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 73.13 111.127 179.94 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.072 0 CA-C-O 119.277 -0.392 . . . . 71.25 110.857 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.04 161.13 20.82 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.477 1.111 . . . . 70.4 108.3 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.23 -53.47 29.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.003 -0.999 . . . . 73.24 110.882 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.4 -36.58 22.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.445 . . . . 72.12 110.863 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -91.08 90.39 7.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 74.43 110.803 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -86.27 4.85 37.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 74.21 110.921 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -120.03 34.69 5.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.118 -0.492 . . . . 73.4 110.859 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.88 -169.93 3.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 75.33 110.868 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.55 125.72 26.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 75.01 110.934 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 31.2 m -51.48 167.64 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 71.22 111.137 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -133.05 -51.19 0.89 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 74.24 110.864 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -148.87 -172.18 4.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 73.32 110.86 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -127.48 130.67 49.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.184 -0.462 . . . . 75.5 110.937 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.64 104.75 14.0 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.447 1.092 . . . . 63.44 108.313 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 43.1 t -73.26 -27.24 23.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 114.979 -1.009 . . . . 55.15 111.132 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.31 -55.41 24.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 71.32 111.145 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.05 -10.87 45.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 75.43 110.872 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 2.4 t70 64.45 59.25 1.0 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 55.43 110.887 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -161.86 127.08 3.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 73.11 110.917 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.72 152.26 2.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 74.33 110.922 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -144.64 142.86 23.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.444 . . . . 63.35 111.157 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 19.6 p -104.41 -175.09 2.7 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.507 1.129 . . . . 64.23 108.331 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -68.73 -39.03 80.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.024 -0.989 . . . . 72.12 111.078 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.16 -18.45 64.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 74.15 110.924 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 5.7 m -80.97 -33.48 33.82 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.524 1.14 . . . . 65.31 108.306 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.33 -15.52 59.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.978 -1.01 . . . . 73.11 110.925 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 tp -105.3 -44.75 4.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 75.04 110.887 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 49.0 t -89.85 -42.49 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 75.21 111.14 179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -77.87 -146.59 2.79 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.762 -0.733 . . . . 71.52 112.471 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -134.24 24.25 3.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.852 0.358 . . . . 75.1 110.837 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -95.99 38.68 1.17 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 71.33 110.842 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 10.3 ttm-85 -94.18 -47.69 6.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 75.15 110.878 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.49 7.14 40.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.199 -0.455 . . . . 75.14 110.83 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -79.94 174.94 11.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 75.22 110.847 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.64 143.97 25.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 75.24 110.916 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 26.9 m -150.71 -176.22 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 74.54 111.133 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 75.42 111.087 179.915 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 119.248 -0.406 . . . . 75.42 110.879 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -72.34 163.44 27.97 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.513 1.133 . . . . 74.32 108.285 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.63 -52.44 17.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.99 -1.005 . . . . 73.14 110.901 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -84.05 -37.15 22.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 74.33 110.941 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 29.3 m80 -88.66 91.71 8.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 74.04 110.882 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -26.29 53.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.239 -0.437 . . . . 73.23 110.87 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -97.93 34.41 1.91 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.232 -0.44 . . . . 72.52 110.891 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.29 113.09 3.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 70.43 110.9 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.3 149.83 40.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 65.44 110.933 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 15.9 m -53.59 175.17 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.289 -0.414 . . . . 72.34 111.19 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -131.04 -40.05 1.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 72.11 110.847 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.15 -170.18 2.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 73.03 110.95 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -117.15 124.64 49.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.277 -0.419 . . . . 74.14 110.93 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -81.35 107.98 14.58 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.552 1.157 . . . . 73.21 108.258 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 91.4 t -74.08 -28.67 23.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.024 -0.989 . . . . 74.44 111.085 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.86 -56.47 20.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 75.24 111.149 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.69 -12.36 39.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.242 -0.436 . . . . 63.24 110.916 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 6.2 t0 64.0 56.36 1.44 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 53.22 110.881 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -161.0 122.99 3.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.453 . . . . 74.14 110.931 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.7 148.64 3.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.138 -0.483 . . . . 71.43 110.943 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -147.33 -178.87 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.252 -0.431 . . . . 72.25 111.153 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 18.6 p -125.23 -175.44 3.31 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.49 1.119 . . . . 75.31 108.323 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -74.29 -36.12 63.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.057 -0.974 . . . . 70.4 111.069 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.67 -27.42 67.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 74.53 111.006 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 67.0 m -81.03 -35.11 32.29 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.447 1.092 . . . . 75.43 108.341 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -76.85 -14.96 59.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.998 -1.001 . . . . 74.43 110.911 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.5 tp -105.32 -44.93 4.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.182 -0.463 . . . . 73.11 110.926 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 45.0 t -89.67 -42.87 14.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 73.55 111.111 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.43 -142.93 1.04 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.742 -0.742 . . . . 72.34 112.453 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -129.7 24.79 5.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.84 0.352 . . . . 75.25 110.878 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -92.36 43.99 1.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 74.02 110.882 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.65 -47.08 7.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.45 . . . . 73.22 110.868 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -88.15 6.95 34.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 75.14 110.848 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 41.7 m170 -81.94 120.33 25.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 74.33 110.87 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.96 143.9 50.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.218 -0.446 . . . . 72.0 110.933 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.8 m -140.92 -173.57 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 72.42 111.16 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 73.2 111.122 179.892 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 N--CA 1.458 -0.062 0 CA-C-O 119.24 -0.409 . . . . 64.23 110.93 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -59.87 165.19 3.32 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.505 1.128 . . . . 54.42 108.306 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.28 -52.82 12.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.003 -0.999 . . . . 75.14 110.824 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -84.12 -37.39 22.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 73.41 110.817 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 27.5 m80 -87.48 120.09 28.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 74.23 110.845 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -98.66 -31.65 11.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 72.44 110.892 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -95.88 34.59 1.5 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.486 . . . . 75.22 110.883 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -153.48 90.3 1.4 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 73.02 110.935 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -57.33 147.32 26.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.446 . . . . 75.45 110.92 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 21.8 m -51.86 171.11 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.273 -0.421 . . . . 70.13 111.172 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -132.45 -39.39 1.02 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.213 -0.449 . . . . 74.22 110.897 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.07 -169.95 1.99 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 73.02 110.88 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -123.32 124.88 43.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.261 -0.427 . . . . 74.44 110.921 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.99 110.22 18.26 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.482 1.114 . . . . 62.33 108.366 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 62.0 t -75.3 -40.71 43.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 114.95 -1.023 . . . . 75.31 111.081 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 3.4 t -51.68 -44.61 63.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 72.31 111.117 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -97.49 -16.28 20.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.45 . . . . 73.01 110.774 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 9.4 t0 63.88 58.08 1.27 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.245 -0.434 . . . . 75.12 110.869 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -163.5 121.19 1.87 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.22 -0.446 . . . . 74.11 110.943 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.86 148.77 3.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.256 -0.429 . . . . 74.3 110.861 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.1 pp -144.55 -179.49 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 74.03 111.132 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.9 p -128.02 -175.56 3.53 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.47 1.106 . . . . 74.32 108.368 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.57 -34.02 67.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.027 -0.988 . . . . 62.32 111.027 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.18 -20.54 63.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 71.52 110.989 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 4.5 m -81.18 -35.52 31.31 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.538 1.149 . . . . 42.12 108.29 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -76.83 -14.88 59.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.07 -0.968 . . . . 75.42 110.866 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 tp -105.23 -44.92 4.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.247 -0.433 . . . . 72.22 110.93 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 43.3 t -89.65 -43.01 14.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.22 -0.445 . . . . 74.4 111.143 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -74.48 -142.07 0.75 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.742 -0.742 . . . . 73.11 112.429 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 11.3 mtp180 -128.87 24.09 5.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.875 0.369 . . . . 73.42 110.883 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -94.59 38.27 1.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 73.25 110.901 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -94.09 -34.18 13.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 72.1 110.865 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -104.99 7.3 34.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 72.14 110.837 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -79.72 -175.88 5.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.834 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.09 143.86 45.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.456 . . . . 74.24 110.958 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 31.4 m -143.12 -176.39 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.233 -0.44 . . . . 74.44 111.169 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 74.01 111.071 179.813 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.526 0.049 0 CA-C-O 119.239 -0.41 . . . . 74.14 110.882 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -93.86 163.18 13.61 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.521 1.138 . . . . 74.01 108.318 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.97 -53.01 22.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.031 -0.986 . . . . 73.21 110.886 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.36 -36.81 22.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 75.34 110.891 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 48.3 m80 -89.29 88.34 7.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.133 -0.485 . . . . 74.32 110.882 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.31 -23.99 46.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 74.45 110.918 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -95.4 34.57 1.43 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.097 -0.501 . . . . 74.24 110.888 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -152.3 172.83 15.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 74.14 110.884 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.11 139.11 53.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.097 -0.502 . . . . 75.13 110.834 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 8.1 m -50.9 169.3 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 73.01 111.15 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -130.39 -43.09 1.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 74.44 110.857 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -154.46 -172.81 4.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 74.33 110.853 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -124.07 127.76 48.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.28 -0.418 . . . . 75.23 110.905 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -82.07 107.21 14.59 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.513 1.133 . . . . 52.31 108.3 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 40.2 t -73.71 -26.76 22.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 114.994 -1.003 . . . . 72.43 111.125 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -56.16 21.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.226 -0.443 . . . . 73.34 111.131 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.32 -12.39 37.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 73.23 110.869 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 1.9 t70 64.27 58.61 1.1 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 65.35 110.874 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -159.22 118.35 2.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 72.05 110.85 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.74 148.83 3.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 71.53 110.856 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -147.41 -179.87 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.452 . . . . 73.04 111.144 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 23.3 p -123.46 -175.68 3.26 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.445 1.091 . . . . 64.35 108.339 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -71.82 -34.3 69.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.992 -1.004 . . . . 64.52 111.104 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.5 -20.5 63.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 75.43 110.928 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 8.1 m -80.87 -35.99 31.91 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.477 1.11 . . . . 61.14 108.312 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 33.4 mtmt -77.17 -14.35 59.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.004 -0.998 . . . . 75.53 110.921 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.1 tp -105.14 -44.61 4.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.239 -0.437 . . . . 74.15 110.962 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 44.1 t -89.68 -42.86 14.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.187 -0.46 . . . . 74.04 111.096 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.79 -140.67 0.91 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.72 -0.752 . . . . 74.54 112.47 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 80.0 mtm180 -132.51 22.78 4.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.853 0.359 . . . . 75.2 110.896 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -96.95 38.64 1.22 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.179 -0.464 . . . . 73.23 110.832 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 4.3 ttt85 -94.25 -43.95 8.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 74.22 110.839 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -93.71 7.13 45.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 73.35 110.812 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.8 m170 -79.78 174.84 11.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 75.15 110.852 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -93.41 143.79 25.95 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.193 -0.458 . . . . 74.52 110.881 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 29.9 m -150.32 -175.03 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 75.14 111.167 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.211 -0.45 . . . . 74.01 111.073 179.833 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.526 0.029 0 CA-C-O 119.311 -0.376 . . . . 63.41 110.826 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -55.02 163.28 1.07 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.544 1.153 . . . . 74.12 108.34 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.82 -54.69 10.65 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.048 -0.978 . . . . 75.25 110.917 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -84.22 -36.88 22.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 75.21 110.941 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 10.0 m170 -88.93 64.2 7.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 74.4 110.833 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -24.52 52.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 74.02 110.896 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -95.54 34.71 1.43 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 73.31 110.775 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -154.71 103.48 2.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 74.41 110.96 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.5 151.98 9.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 74.32 110.94 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 27.6 m -69.67 172.15 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.457 . . . . 63.24 111.073 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -129.46 -45.55 1.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 71.01 110.892 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.11 -170.1 3.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 72.2 110.895 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -123.59 129.25 50.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 74.24 110.902 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -85.78 106.4 17.0 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.548 1.155 . . . . 73.13 108.264 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 99.7 t -75.01 -39.89 44.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 114.948 -1.024 . . . . 71.32 111.127 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 1.2 t -51.34 -39.18 56.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 74.22 111.107 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -106.75 -9.5 16.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.296 -0.411 . . . . 63.2 110.841 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 5.7 t70 61.43 55.2 2.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 75.54 110.868 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.65 127.5 6.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 75.24 110.876 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.89 152.36 2.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.214 -0.448 . . . . 74.4 110.906 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -146.29 143.25 21.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.193 -0.458 . . . . 73.5 111.124 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 14.8 p -101.09 -175.4 2.86 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.554 1.159 . . . . 72.21 108.343 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -71.3 -41.28 70.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.062 -0.972 . . . . 73.33 111.11 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.23 -25.35 61.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.288 -0.414 . . . . 73.04 110.919 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 62.9 m -81.22 -33.83 32.6 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.449 1.093 . . . . 64.24 108.301 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.38 -16.07 59.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.045 -0.979 . . . . 73.14 110.941 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.7 tp -105.68 -45.67 4.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 64.23 110.897 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 42.1 t -89.66 -43.21 14.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 73.51 111.192 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -72.86 -149.3 1.04 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.745 -0.74 . . . . 64.05 112.509 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.21 22.5 4.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.818 0.342 . . . . 75.33 110.843 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -90.04 47.94 1.51 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 64.3 110.901 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -94.07 -49.41 5.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 73.42 110.91 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -82.12 0.48 40.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.466 . . . . 75.24 110.864 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 38.6 m170 -79.85 120.9 24.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.252 -0.431 . . . . 72.22 110.821 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.53 153.9 18.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 74.31 110.931 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.5 m -147.7 -172.99 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 73.43 111.136 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 74.24 111.103 179.95 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.527 0.073 0 CA-C-O 119.285 -0.388 . . . . 75.31 110.811 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -77.01 162.0 27.89 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.566 1.166 . . . . 63.34 108.272 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.7 mp -71.62 -50.65 28.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.964 -1.017 . . . . 74.54 110.97 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -84.14 -38.74 20.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.183 -0.462 . . . . 75.32 110.894 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -88.49 110.85 21.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 73.22 110.9 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -90.4 -32.99 16.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 61.41 110.915 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -95.23 34.78 1.37 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.074 -0.512 . . . . 74.1 110.862 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.32 106.54 2.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 75.12 110.881 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 8.2 mtpp -72.48 149.4 44.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.505 . . . . 73.01 110.882 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 12.6 m -51.24 169.51 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.243 -0.435 . . . . 75.33 111.135 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -127.74 -38.76 1.85 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 73.5 110.909 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.3 -170.04 1.97 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 73.23 110.836 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -118.46 127.98 54.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 75.1 110.881 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -82.13 108.47 15.63 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.561 1.163 . . . . 72.21 108.248 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 61.6 t -73.81 -27.39 22.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 114.994 -1.003 . . . . 73.31 111.142 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.32 -55.78 24.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 74.51 111.113 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.58 -11.27 40.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.436 . . . . 63.13 110.842 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 18.4 t0 63.63 54.15 1.92 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 75.14 110.803 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -157.73 126.07 5.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.246 -0.434 . . . . 73.11 110.881 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.13 150.91 4.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 74.23 110.924 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.7 pp -149.88 -179.4 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 74.43 111.107 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 17.5 p -126.78 -175.63 3.46 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.431 1.082 . . . . 70.22 108.294 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -73.12 -38.24 66.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.064 -0.971 . . . . 74.13 111.145 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -27.43 65.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 74.32 110.969 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 67.6 m -81.01 -34.07 33.18 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.514 1.134 . . . . 74.43 108.3 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -76.22 -15.42 60.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.977 -1.01 . . . . 75.4 110.911 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.73 -45.54 4.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 75.13 110.92 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 53.5 t -89.64 -43.0 14.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.158 -0.474 . . . . 63.23 111.143 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.58 -146.55 0.93 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.667 -0.778 . . . . 70.22 112.469 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 53.2 ttt180 -128.12 24.68 5.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.771 0.32 . . . . 75.23 110.884 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 62.2 m-70 -94.12 39.91 1.08 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 74.21 110.856 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 7.7 ttm-85 -87.34 -45.66 10.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 74.42 110.856 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -89.57 5.53 45.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.178 -0.465 . . . . 72.42 110.854 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 41.5 m170 -81.04 120.17 24.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.218 -0.446 . . . . 71.24 110.882 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.94 143.89 50.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 72.34 110.875 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 19.0 m -140.37 -173.58 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 73.04 111.098 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 73.5 111.117 179.884 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 119.227 -0.416 . . . . 75.31 110.923 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -75.98 161.19 29.12 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.505 1.128 . . . . 75.24 108.307 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 10.6 mp -70.63 -51.74 25.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.027 -0.988 . . . . 73.42 110.989 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -84.03 -35.23 23.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.458 . . . . 64.33 110.899 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 22.6 m80 -94.64 93.74 7.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.106 -0.497 . . . . 70.13 110.859 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.03 -23.81 38.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.459 . . . . 74.01 110.857 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -95.44 34.62 1.43 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 75.04 110.872 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.75 112.98 1.94 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 72.21 110.894 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 14.4 pttt -72.11 146.08 47.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 71.05 110.882 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 31.6 m -51.94 171.25 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.197 -0.456 . . . . 72.21 111.147 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -132.33 -38.72 1.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.169 -0.469 . . . . 73.14 110.89 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -158.61 -170.1 2.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 73.33 110.884 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -129.0 128.11 43.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 74.3 110.878 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -83.64 109.78 17.73 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.431 1.082 . . . . 74.43 108.294 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 39.6 t -75.27 -42.19 43.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 114.961 -1.018 . . . . 75.43 111.068 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 3.5 t -51.69 -44.14 63.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 74.33 111.113 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -97.5 -14.95 20.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 73.14 110.868 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.85 56.54 1.86 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 63.54 110.847 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -158.77 120.36 3.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.465 . . . . 75.44 110.927 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.25 148.91 5.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 72.24 110.875 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -144.88 -179.77 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.19 -0.459 . . . . 71.33 111.072 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.1 p -126.82 -175.52 3.43 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.592 1.183 . . . . 75.24 108.34 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.87 -32.68 65.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.002 -0.999 . . . . 60.31 111.077 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.86 -21.09 62.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 73.24 110.955 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 6.8 m -81.17 -35.35 31.55 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.485 1.116 . . . . 75.21 108.333 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? -76.96 -14.69 59.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.987 -1.006 . . . . 72.21 110.945 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.2 tp -105.38 -44.82 4.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 73.43 110.878 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 44.1 t -89.71 -42.91 14.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 74.54 111.131 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.54 -142.45 1.02 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.78 -0.724 . . . . 60.51 112.467 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 5.2 mtt85 -132.38 23.27 4.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.879 0.371 . . . . 71.33 110.881 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -94.55 38.36 1.11 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.162 -0.472 . . . . 74.44 110.825 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -94.22 -42.46 8.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.246 -0.433 . . . . 74.43 110.809 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -94.85 7.19 46.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.222 -0.444 . . . . 73.12 110.874 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.3 m170 -79.84 176.13 10.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 64.02 110.857 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.91 143.94 26.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 74.13 110.889 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 32.8 m -150.24 -175.61 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 73.52 111.198 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 72.1 111.072 179.878 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.141 0 CA-C-O 119.227 -0.416 . . . . 71.23 110.937 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -81.36 160.96 23.98 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.481 1.113 . . . . 74.45 108.269 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.0 mp -76.43 -45.96 29.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.927 -1.033 . . . . 63.5 110.944 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -84.4 -34.79 23.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 73.31 110.854 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -99.44 78.49 2.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.137 -0.483 . . . . 75.22 110.878 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -62.74 -31.1 71.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.235 -0.438 . . . . 75.31 110.919 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -94.31 34.72 1.25 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.171 -0.468 . . . . 63.44 110.806 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.69 112.83 3.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.279 -0.418 . . . . 63.2 110.916 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 18.3 mtpt -72.51 144.62 47.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.185 -0.461 . . . . 73.43 110.845 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 29.3 m -51.51 170.56 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.19 -0.459 . . . . 74.44 111.18 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -131.85 -38.71 1.12 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.449 . . . . 63.04 110.912 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.69 -170.03 2.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.197 -0.456 . . . . 74.32 110.868 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -128.54 127.98 43.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 75.14 110.949 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -83.72 109.84 17.82 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.45 1.094 . . . . 70.51 108.265 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 22.0 t -75.23 -42.11 44.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 114.939 -1.028 . . . . 75.41 111.132 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 3.5 t -51.69 -44.07 63.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 72.42 111.154 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -97.56 -15.03 20.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.157 -0.474 . . . . 74.12 110.843 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 62.85 56.54 1.86 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.189 -0.46 . . . . 72.22 110.913 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -159.04 120.25 3.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 74.41 110.917 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.17 148.87 5.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 75.51 110.905 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -145.37 -179.63 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 75.02 111.099 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 25.6 p -126.74 -175.55 3.44 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.544 1.153 . . . . 72.21 108.317 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.81 -33.03 65.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.97 -1.014 . . . . 75.32 111.131 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.43 -20.98 62.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.45 . . . . 75.1 110.947 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 7.7 m -81.26 -35.44 31.16 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.52 1.138 . . . . 74.22 108.288 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 26.0 mtmt -77.02 -14.77 59.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.99 -1.004 . . . . 75.33 110.886 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.3 tp -105.18 -44.7 4.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.232 -0.44 . . . . 74.22 110.938 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 44.3 t -89.71 -42.81 14.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 72.14 111.075 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.96 -141.64 1.06 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.733 -0.746 . . . . 72.13 112.455 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 58.2 mtp180 -132.65 23.62 4.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.806 0.336 . . . . 73.25 110.819 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -94.78 37.95 1.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.235 -0.439 . . . . 70.52 110.894 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -94.14 -42.06 9.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.25 -0.432 . . . . 75.24 110.865 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 13.4 p-10 -95.34 7.14 47.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 64.12 110.895 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -79.79 177.16 9.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 74.2 110.913 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -96.99 143.94 27.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 73.13 110.932 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 34.5 m -150.4 -175.99 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 63.43 111.128 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 71.34 111.083 179.993 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 119.319 -0.372 . . . . 75.05 110.833 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.39 160.93 25.21 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.445 1.091 . . . . 75.1 108.283 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 2.5 mp -66.3 -55.29 16.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.984 -1.007 . . . . 73.23 110.929 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -84.35 -33.73 23.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.249 -0.432 . . . . 74.34 110.895 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -94.6 75.01 3.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 74.1 110.832 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -25.42 67.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 73.44 110.895 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.55 34.6 1.45 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.107 -0.497 . . . . 73.24 110.86 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -130.47 -172.61 2.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 73.52 110.916 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.9 mttp -136.95 120.88 17.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.226 -0.443 . . . . 70.43 110.896 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 19.8 m -51.31 165.03 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 72.33 111.183 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -134.05 -50.87 0.83 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 64.13 110.844 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.88 -170.1 3.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.187 -0.46 . . . . 74.13 110.932 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -127.12 129.56 48.16 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.323 -0.398 . . . . 73.3 110.951 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.33 105.31 14.18 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.477 1.111 . . . . 73.42 108.24 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 58.8 t -73.27 -26.16 22.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 114.966 -1.015 . . . . 74.45 111.12 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.6 -55.79 20.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 71.32 111.198 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -89.76 -10.32 46.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 54.15 110.866 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 6.1 t70 64.15 58.25 1.17 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.177 -0.465 . . . . 63.0 110.862 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -160.22 127.13 4.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 72.53 110.893 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.35 152.64 2.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 74.34 110.962 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -144.84 142.77 22.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 73.33 111.087 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 14.8 p -107.12 -174.32 2.51 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.475 1.109 . . . . 72.23 108.31 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.37 -44.45 78.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.032 -0.985 . . . . 72.41 111.088 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -20.35 62.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.449 . . . . 75.04 110.914 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 24.8 m -80.82 -32.55 35.16 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.497 1.123 . . . . 75.24 108.325 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 4.5 mtpm? -77.34 -15.85 59.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.027 -0.988 . . . . 75.13 110.9 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.6 tp -105.38 -44.85 4.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.463 . . . . 61.03 110.912 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 61.5 t -89.82 -42.57 14.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.215 -0.448 . . . . 73.54 111.118 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -78.25 -148.79 3.89 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.739 -0.743 . . . . 72.42 112.478 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 8.3 ttm180 -134.25 24.75 3.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.799 0.333 . . . . 74.03 110.841 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -95.47 38.84 1.14 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 74.01 110.858 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 3.6 ttp85 -94.22 -48.0 6.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.244 -0.434 . . . . 73.23 110.842 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -90.39 7.36 39.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 64.01 110.867 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 31.5 m170 -79.94 175.01 11.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 74.54 110.896 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 52.0 mm-40 -95.03 147.55 23.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.29 -0.414 . . . . 70.43 110.952 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 35.9 m -150.33 -176.06 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 71.52 111.128 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.46 . . . . 64.41 111.132 179.869 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.086 0 CA-C-O 119.242 -0.408 . . . . 75.11 110.944 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -54.9 161.26 1.66 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.494 1.121 . . . . 70.51 108.301 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.2 mp -68.63 -54.77 14.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.969 -1.014 . . . . 72.31 110.905 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -83.98 -35.43 23.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.167 -0.469 . . . . 72.32 110.926 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 16.3 m80 -93.41 62.52 3.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.122 -0.49 . . . . 74.23 110.854 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -57.82 -23.6 53.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 73.13 110.947 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.45 34.6 1.43 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.122 -0.49 . . . . 73.44 110.809 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -151.47 89.29 1.48 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 73.42 110.872 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.97 121.0 5.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.103 -0.499 . . . . 73.01 110.916 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 16.7 m -51.74 163.79 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.445 . . . . 73.0 111.129 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -117.41 -36.77 3.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.15 110.849 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -162.58 -168.54 1.85 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 71.24 110.813 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -132.52 138.64 47.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 74.04 110.905 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -74.59 116.43 15.27 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.539 1.149 . . . . 74.23 108.245 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 68.7 t -74.74 -38.47 44.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 114.972 -1.013 . . . . 73.24 111.083 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.98 -53.64 55.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 74.33 111.173 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -86.14 -10.36 54.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 72.43 110.859 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 34.2 t70 57.31 50.38 11.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 73.25 110.815 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -148.61 127.33 12.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 70.25 110.913 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.17 150.78 3.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.224 -0.444 . . . . 74.55 110.878 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -155.67 142.82 11.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.197 -0.456 . . . . 74.15 111.127 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 25.5 p -97.79 -175.02 3.05 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.488 1.118 . . . . 71.22 108.279 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.2 -33.73 67.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.934 -1.03 . . . . 71.14 111.079 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.22 -24.75 65.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.261 -0.427 . . . . 73.42 110.904 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 34.5 m -80.95 -31.69 34.82 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.499 1.124 . . . . 74.21 108.291 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 41.4 mtpt -77.16 -16.59 59.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.981 -1.009 . . . . 73.25 110.971 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.3 tp -105.48 -45.22 4.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.193 -0.458 . . . . 72.43 110.929 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 61.9 t -89.87 -42.69 14.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.451 . . . . 72.41 111.117 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -72.35 -147.37 0.71 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.706 -0.759 . . . . 70.25 112.484 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.0 21.74 6.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.838 0.352 . . . . 74.44 110.886 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -95.97 39.69 1.14 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.111 -0.495 . . . . 74.02 110.93 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -94.18 -40.89 9.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.237 -0.438 . . . . 74.31 110.901 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.37 7.15 46.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 60.13 110.792 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.8 m170 -83.19 -175.26 5.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.262 -0.426 . . . . 72.11 110.877 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -117.01 147.22 42.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 75.21 110.883 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 17.9 m -139.71 -173.21 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.452 . . . . 74.44 111.15 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 72.25 111.098 179.895 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.526 0.028 0 CA-C-O 119.307 -0.377 . . . . 70.0 110.829 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.3 164.17 1.01 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.521 1.138 . . . . 73.41 108.33 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.4 mp -77.02 -48.03 19.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.98 -1.009 . . . . 75.34 110.918 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -84.17 -43.27 15.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 72.21 110.858 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 20.7 m80 -89.77 62.11 5.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 75.21 110.869 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -52.24 -29.77 24.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.177 -0.465 . . . . 73.24 110.912 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -93.91 35.01 1.17 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 62.32 110.913 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.77 96.57 2.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 75.35 110.872 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.48 126.38 27.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 73.1 110.902 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 16.8 m -51.77 163.34 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.434 . . . . 74.43 111.102 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -118.96 -37.41 3.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 71.11 110.878 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.21 -168.45 2.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 73.31 110.831 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -132.71 138.69 47.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 72.21 110.947 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.65 113.75 10.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.575 1.172 . . . . 64.2 108.359 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 60.5 t -74.21 -28.67 23.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.003 -0.998 . . . . 72.53 111.107 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.73 -56.34 16.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.453 . . . . 65.44 111.141 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.36 -4.59 55.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.246 -0.434 . . . . 72.41 110.843 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 6.2 t70 57.05 50.64 11.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 73.03 110.862 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.52 127.41 17.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 74.21 110.929 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.64 150.67 3.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.162 -0.472 . . . . 74.43 110.919 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -156.45 142.57 10.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 74.35 111.163 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 20.8 p -97.47 -175.1 3.1 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.434 1.084 . . . . 72.33 108.31 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.02 -35.9 69.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.971 -1.013 . . . . 60.4 111.081 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.98 -24.71 67.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 72.15 110.883 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 37.0 m -81.08 -32.39 33.97 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.422 1.076 . . . . 64.1 108.27 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 30.9 mtmt -76.45 -16.53 59.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.99 -1.005 . . . . 73.42 110.842 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.3 tp -105.74 -45.51 4.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 74.43 110.939 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 53.0 t -89.73 -42.93 14.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.16 -0.473 . . . . 74.41 111.197 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -71.79 -149.2 0.76 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.743 -0.742 . . . . 64.02 112.462 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.52 20.7 6.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.808 0.337 . . . . 74.24 110.874 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -96.71 39.38 1.17 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 74.33 110.907 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.08 -47.94 6.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 73.22 110.882 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.76 2.03 39.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.223 -0.444 . . . . 75.32 110.891 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 36.3 m170 -79.98 -176.46 5.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 74.5 110.876 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.09 144.61 42.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.196 -0.456 . . . . 73.4 110.884 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.9 m -135.57 -175.23 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.205 -0.452 . . . . 72.44 111.124 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.097 -0.501 . . . . 75.41 111.038 179.898 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.085 0 CA-C-O 119.278 -0.392 . . . . 71.12 110.862 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -61.75 162.01 9.3 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.496 1.122 . . . . 73.02 108.271 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 3.9 mp -68.25 -53.1 26.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.98 -1.009 . . . . 73.25 110.94 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -84.27 -35.39 23.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 65.44 110.879 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -91.98 71.03 5.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 70.13 110.884 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -24.36 67.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.203 -0.453 . . . . 71.05 110.914 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -95.44 34.73 1.41 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.481 . . . . 75.41 110.77 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.1 -169.3 2.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 74.35 110.892 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 9.7 tttt -140.71 127.61 20.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.485 . . . . 73.42 110.855 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 3.3 m -50.61 167.81 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 71.51 111.081 179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 39.6 t-20 -127.82 -38.08 1.89 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 73.43 110.856 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 1.2 mmt -164.17 -171.63 2.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 71.32 110.863 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -117.07 126.93 53.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.216 -0.447 . . . . 71.53 110.954 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -83.43 107.06 15.68 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.45 1.094 . . . . 73.24 108.281 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 60.4 t -75.49 -41.27 42.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.011 -0.995 . . . . 64.13 111.1 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 1.2 t -50.49 -34.76 26.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.476 . . . . 71.34 111.079 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -111.73 -9.44 14.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.266 -0.424 . . . . 54.52 110.827 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 9.2 t0 60.23 55.18 3.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 72.23 110.935 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -158.37 125.99 5.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.126 -0.488 . . . . 73.43 110.942 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.1 149.18 19.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.457 . . . . 73.32 110.904 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -150.32 -179.28 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 74.01 111.119 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 27.6 p -123.51 -175.51 3.22 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.509 1.131 . . . . 64.11 108.225 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -73.29 -32.28 64.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.983 -1.008 . . . . 70.52 111.06 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.64 -25.5 67.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 74.32 110.951 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 57.8 m -81.03 -35.45 31.86 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 124.568 1.168 . . . . 72.32 108.311 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 4.0 mtmt -76.91 -14.76 59.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.976 -1.011 . . . . 71.31 110.869 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.8 tp -105.38 -45.0 4.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.266 -0.425 . . . . 74.13 110.903 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 43.6 t -89.64 -43.0 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 74.51 111.122 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.94 -142.28 0.67 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.715 -0.755 . . . . 70.43 112.478 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -128.26 23.17 6.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.766 0.317 . . . . 72.44 110.896 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 -97.86 39.56 1.21 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.162 -0.472 . . . . 75.41 110.898 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -84.48 -40.51 17.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 71.2 110.859 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -97.95 7.05 46.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 65.3 110.905 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.3 m170 -80.5 120.48 24.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 74.14 110.813 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -59.64 163.66 4.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 73.03 110.913 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 14.0 m -149.11 -176.32 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 73.01 111.137 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.2 -0.455 . . . . 65.1 111.138 179.798 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 119.221 -0.418 . . . . 74.13 110.888 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.32 161.59 16.28 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.499 1.124 . . . . 73.0 108.31 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.76 -53.26 34.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.008 -0.996 . . . . 75.31 110.946 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -84.62 -36.35 22.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 73.24 110.869 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 34.0 m80 -91.47 88.94 7.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 64.32 110.776 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -78.5 -25.46 45.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 71.51 110.86 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -95.5 34.58 1.44 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 74.5 110.896 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -141.3 179.57 6.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 75.32 110.908 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.14 128.34 41.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 73.34 110.88 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 22.8 m -50.81 168.0 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.157 -0.474 . . . . 74.41 111.165 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -127.6 -38.49 1.9 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.258 -0.428 . . . . 72.34 110.893 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -164.52 -170.15 1.96 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 72.11 110.831 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -120.11 127.4 52.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 72.21 110.956 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -80.67 108.05 13.99 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.446 1.091 . . . . 53.34 108.268 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 53.1 t -73.8 -28.49 24.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 114.955 -1.02 . . . . 64.54 111.191 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -55.6 28.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.133 -0.485 . . . . 75.54 111.191 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.5 -11.31 40.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 74.15 110.84 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 4.8 t70 63.51 55.05 1.82 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 75.43 110.889 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -157.39 125.12 5.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 72.52 110.88 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.86 148.87 6.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.24 -0.436 . . . . 72.34 110.864 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.2 pp -147.24 -179.88 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 71.4 111.133 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 22.1 p -126.97 -175.67 3.49 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.465 1.103 . . . . 73.13 108.291 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -71.89 -34.68 69.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.992 -1.004 . . . . 74.41 111.123 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -23.69 67.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 73.04 110.942 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 51.7 m -80.97 -36.08 31.3 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.54 1.15 . . . . 73.41 108.317 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.74 -14.7 59.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.939 -1.028 . . . . 75.32 110.929 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.4 tp -105.19 -44.99 4.62 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.213 -0.448 . . . . 74.43 110.89 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 42.1 t -89.54 -43.08 14.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 74.14 111.104 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.71 -142.41 1.07 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.753 -0.737 . . . . 70.02 112.517 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 3.3 mtp85 -132.98 24.77 4.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.831 0.348 . . . . 74.55 110.827 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 50.1 m-70 -93.8 40.73 1.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 74.03 110.832 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 9.3 ptt85 -89.07 -39.74 13.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.277 -0.42 . . . . 71.41 110.875 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -94.8 3.8 54.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.199 -0.455 . . . . 73.1 110.851 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 48.5 m170 -79.95 120.18 23.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 74.3 110.855 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.84 143.89 50.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 62.22 110.891 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.7 m -139.69 -173.4 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.475 . . . . 71.54 111.089 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.231 -0.44 . . . . 74.42 111.097 179.907 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.085 0 CA-C-O 119.292 -0.385 . . . . 75.11 110.861 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -95.05 160.98 14.32 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 75.01 108.267 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.25 -55.63 20.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.961 -1.018 . . . . 73.01 110.883 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -84.56 -33.63 23.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.429 . . . . 73.21 110.859 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -94.96 65.85 2.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.476 . . . . 74.31 110.872 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.64 -28.48 67.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.435 . . . . 64.4 110.9 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -93.23 35.1 1.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 64.1 110.843 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -135.54 175.31 9.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 73.14 110.883 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.63 113.55 13.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 74.11 110.92 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 16.0 m -51.43 160.94 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.424 . . . . 75.11 111.151 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -122.87 -39.21 2.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 74.42 110.826 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.26 -169.4 3.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.471 . . . . 71.11 110.845 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -133.31 138.84 46.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.224 -0.444 . . . . 71.25 110.894 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.66 114.79 12.31 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.495 1.122 . . . . 75.45 108.274 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 20.7 t -74.29 -30.53 26.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 114.992 -1.004 . . . . 73.43 111.145 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.58 -56.08 21.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 73.55 111.18 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.59 -5.2 56.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.265 -0.425 . . . . 74.21 110.921 179.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 23.8 t70 56.59 50.08 13.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 70.13 110.893 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -143.81 127.32 16.94 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.143 -0.48 . . . . 74.23 110.916 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.33 151.02 3.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 73.44 110.944 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -156.32 142.84 10.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 73.24 111.148 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.2 p -97.75 -175.19 3.1 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.524 1.14 . . . . 71.34 108.322 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.29 -32.69 66.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.0 -1.0 . . . . 60.44 111.118 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.31 -22.2 62.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.26 -0.427 . . . . 72.42 110.858 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 12.8 m -80.89 -33.6 34.16 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.446 1.091 . . . . 55.01 108.363 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -76.91 -15.6 59.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.977 -1.011 . . . . 74.53 110.9 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.9 tp -105.58 -45.15 4.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 73.24 110.879 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 48.2 t -89.66 -42.8 14.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 71.55 111.207 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.48 -145.0 0.75 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.708 -0.758 . . . . 62.42 112.474 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -129.58 21.55 5.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.79 0.328 . . . . 74.33 110.907 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -99.28 39.86 1.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.244 -0.435 . . . . 75.11 110.864 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -94.24 -48.19 6.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 73.35 110.854 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -84.54 2.87 39.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.243 -0.435 . . . . 60.24 110.899 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.0 m170 -80.22 -176.75 5.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.461 . . . . 73.12 110.854 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -112.92 151.81 30.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 74.23 110.901 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.9 m -143.01 -175.88 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.462 . . . . 75.42 111.122 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 72.5 111.064 179.901 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.088 0 CA-C-O 119.252 -0.404 . . . . 70.23 110.892 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.92 161.0 1.76 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.505 1.128 . . . . 73.4 108.332 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 10.5 mp -73.58 -47.92 36.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.048 -0.978 . . . . 72.52 110.906 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -84.21 -42.26 16.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.213 -0.448 . . . . 74.1 110.875 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -91.89 62.11 4.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.078 -0.51 . . . . 72.34 110.828 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.44 -29.88 26.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 74.13 110.858 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -93.99 34.98 1.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.156 -0.475 . . . . 73.04 110.942 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.8 96.68 2.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.149 -0.478 . . . . 74.5 110.848 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -56.76 132.67 52.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 74.4 110.899 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 20.0 m -61.3 165.73 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 75.03 111.149 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -119.65 -35.54 3.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 74.24 110.864 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -162.43 -168.27 1.8 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 70.02 110.934 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -132.6 138.51 47.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.289 -0.414 . . . . 73.21 110.931 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.8 114.08 10.55 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.506 1.129 . . . . 72.22 108.278 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 60.1 t -74.32 -29.55 24.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 114.972 -1.013 . . . . 74.25 111.083 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -56.23 18.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 75.23 111.171 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -90.79 -5.1 56.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 74.51 110.895 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 3.7 t0 56.99 50.62 11.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 74.45 110.851 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -144.06 127.34 16.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 74.45 110.899 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.58 150.27 3.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.243 -0.435 . . . . 71.35 110.882 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -156.27 142.6 10.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.194 -0.457 . . . . 74.42 111.157 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.5 p -95.8 -175.21 3.36 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 74.44 108.279 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.31 -32.72 66.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.993 -1.003 . . . . 72.41 111.096 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.02 -24.04 64.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 74.42 110.859 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 23.4 m -81.27 -31.32 33.73 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.514 1.134 . . . . 53.42 108.336 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -76.46 -17.54 59.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.002 -0.999 . . . . 72.03 110.873 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.9 tp -105.99 -45.88 4.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 72.22 110.922 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 44.6 t -89.81 -43.3 14.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.203 -0.453 . . . . 63.43 111.106 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -67.72 -153.8 0.42 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 74.45 112.551 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -120.08 19.29 12.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.818 0.342 . . . . 73.4 110.852 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -96.26 47.49 1.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 75.24 110.861 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.11 -51.16 4.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.23 -0.441 . . . . 74.41 110.843 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.9 7.2 31.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 74.44 110.881 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 33.5 m170 -79.81 -176.41 5.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.47 . . . . 72.33 110.933 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -117.55 146.07 43.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 73.24 110.917 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.9 m -136.17 -174.51 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 72.05 111.157 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.454 . . . . 73.15 111.069 179.931 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 69.1 m . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.897 0.38 . . . . 71.43 110.843 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 23.3 t-80 -168.34 65.47 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 72.44 110.856 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 20.1 pt -104.58 37.64 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 74.3 111.149 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 27.6 mtp180 -141.67 148.2 38.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.155 -0.475 . . . . 74.23 110.851 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 152.59 161.5 10.29 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.726 -0.75 . . . . 73.35 112.497 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 8.8 mt -119.09 56.96 0.89 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.873 0.368 . . . . 72.2 110.907 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -70.44 -173.57 0.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 72.42 110.873 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.2 161.09 29.66 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.438 1.086 . . . . 60.45 108.334 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 1.1 mp -74.1 -47.95 32.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.057 -0.974 . . . . 74.03 110.943 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.15 -36.02 23.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 75.15 110.902 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 49.4 m80 -93.97 104.5 16.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.132 -0.485 . . . . 75.03 110.888 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.62 -32.83 25.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 72.34 110.869 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -94.95 34.71 1.33 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 62.01 110.845 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -155.71 113.08 3.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 63.42 110.885 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.17 153.28 36.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 74.04 110.943 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 12.7 m -53.59 174.52 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 72.4 111.14 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 55.5 t-20 -132.83 -40.86 0.94 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 73.4 110.928 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.1 -170.12 2.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 74.21 110.9 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -119.61 123.75 44.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 75.25 110.939 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.44 108.49 14.11 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.489 1.118 . . . . 55.33 108.35 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 65.7 t -73.81 -26.79 21.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.013 -0.994 . . . . 74.24 111.123 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.63 -56.73 16.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.193 -0.458 . . . . 75.33 111.181 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -89.91 -12.45 38.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.197 -0.456 . . . . 55.21 110.866 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 5.5 t0 64.33 58.67 1.08 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.209 -0.451 . . . . 75.31 110.944 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -162.52 124.39 2.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 73.51 110.92 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.81 149.33 6.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.174 -0.466 . . . . 73.33 110.896 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -147.87 -178.87 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 71.11 111.192 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 20.4 p -125.7 -175.29 3.3 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.549 1.156 . . . . 74.2 108.308 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -73.15 -35.84 66.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.013 -0.994 . . . . 72.21 111.064 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.67 -24.16 67.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.192 -0.458 . . . . 74.23 110.894 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 30.1 m -81.17 -34.87 32.09 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.558 1.161 . . . . 74.51 108.353 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 28.3 mtmt -76.89 -14.86 59.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.036 -0.983 . . . . 74.33 110.957 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 5.7 tp -105.35 -44.86 4.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 72.13 110.922 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 47.2 t -89.73 -42.8 14.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.2 -0.455 . . . . 72.33 111.12 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -74.89 -142.33 0.84 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.79 -0.719 . . . . 74.42 112.48 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -129.08 23.95 5.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.855 0.359 . . . . 74.51 110.859 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -95.65 37.35 1.21 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 63.22 110.876 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 10.5 ptt-85 -94.31 -32.7 13.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 74.24 110.872 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -105.03 7.23 33.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 71.15 110.844 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 51.0 m170 -79.68 174.92 11.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 65.14 110.885 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -99.23 144.46 28.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 74.34 110.961 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 34.0 m -146.21 -175.88 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.25 -0.432 . . . . 63.43 111.14 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -137.56 110.15 7.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 73.13 111.127 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -94.54 138.22 32.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.281 -0.418 . . . . 71.3 111.135 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 63.37 105.29 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 74.44 110.829 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 3.9 m -56.61 115.13 2.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 73.43 110.841 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.146 -0.479 . . . . 70.25 110.93 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 45.9 m . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.88 0.372 . . . . 75.43 110.847 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 25.2 m-70 -117.03 33.35 5.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.113 -0.494 . . . . 73.3 110.865 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 15.4 tt -77.42 -28.54 16.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 72.34 111.116 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 57.87 39.46 26.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 74.1 110.846 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -59.63 129.14 48.21 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.744 -0.741 . . . . 71.31 112.505 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 1.3 mt -108.25 74.32 0.93 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.841 0.353 . . . . 72.42 110.911 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.14 -169.82 1.54 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 71.25 110.857 179.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.04 161.13 20.82 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.477 1.111 . . . . 70.4 108.3 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.23 -53.47 29.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.003 -0.999 . . . . 73.24 110.882 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.4 -36.58 22.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.445 . . . . 72.12 110.863 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -91.08 90.39 7.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 74.43 110.803 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -86.27 4.85 37.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 74.21 110.921 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -120.03 34.69 5.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.118 -0.492 . . . . 73.4 110.859 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.88 -169.93 3.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 75.33 110.868 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.55 125.72 26.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 75.01 110.934 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 31.2 m -51.48 167.64 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 71.22 111.137 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -133.05 -51.19 0.89 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 74.24 110.864 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -148.87 -172.18 4.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 73.32 110.86 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -127.48 130.67 49.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.184 -0.462 . . . . 75.5 110.937 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.64 104.75 14.0 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.447 1.092 . . . . 63.44 108.313 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 43.1 t -73.26 -27.24 23.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 114.979 -1.009 . . . . 55.15 111.132 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.31 -55.41 24.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 71.32 111.145 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.05 -10.87 45.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 75.43 110.872 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 2.4 t70 64.45 59.25 1.0 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 55.43 110.887 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -161.86 127.08 3.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 73.11 110.917 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.72 152.26 2.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 74.33 110.922 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -144.64 142.86 23.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.444 . . . . 63.35 111.157 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 19.6 p -104.41 -175.09 2.7 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.507 1.129 . . . . 64.23 108.331 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -68.73 -39.03 80.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.024 -0.989 . . . . 72.12 111.078 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.16 -18.45 64.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 74.15 110.924 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 5.7 m -80.97 -33.48 33.82 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.524 1.14 . . . . 65.31 108.306 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.33 -15.52 59.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.978 -1.01 . . . . 73.11 110.925 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 tp -105.3 -44.75 4.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 75.04 110.887 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 49.0 t -89.85 -42.49 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 75.21 111.14 179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -77.87 -146.59 2.79 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.762 -0.733 . . . . 71.52 112.471 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -134.24 24.25 3.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.852 0.358 . . . . 75.1 110.837 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -95.99 38.68 1.17 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 71.33 110.842 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 10.3 ttm-85 -94.18 -47.69 6.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 75.15 110.878 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.49 7.14 40.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.199 -0.455 . . . . 75.14 110.83 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -79.94 174.94 11.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 75.22 110.847 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.64 143.97 25.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 75.24 110.916 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 26.9 m -150.71 -176.22 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 74.54 111.133 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -139.34 -170.54 2.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 75.42 111.087 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -128.66 168.04 16.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 52.21 111.096 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -158.28 163.67 37.17 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.218 -0.447 . . . . 75.12 110.925 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 63.19 -172.02 0.17 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 65.23 110.861 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 73.43 110.865 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 70.0 m . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.926 0.393 . . . . 70.3 110.832 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 19.6 m-70 -55.87 130.01 41.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.122 -0.49 . . . . 74.43 110.823 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 11.8 tt -141.64 146.24 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 75.4 111.058 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -129.72 171.93 12.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 73.42 110.888 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -111.9 -166.99 17.96 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.727 -0.749 . . . . 74.32 112.467 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -127.06 104.88 8.22 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.818 0.342 . . . . 75.24 110.93 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.3 -174.19 4.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 75.42 110.879 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -72.34 163.44 27.97 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.513 1.133 . . . . 74.32 108.285 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.63 -52.44 17.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.99 -1.005 . . . . 73.14 110.901 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -84.05 -37.15 22.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 74.33 110.941 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 29.3 m80 -88.66 91.71 8.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 74.04 110.882 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -26.29 53.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.239 -0.437 . . . . 73.23 110.87 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -97.93 34.41 1.91 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.232 -0.44 . . . . 72.52 110.891 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.29 113.09 3.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 70.43 110.9 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.3 149.83 40.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 65.44 110.933 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 15.9 m -53.59 175.17 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.289 -0.414 . . . . 72.34 111.19 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -131.04 -40.05 1.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 72.11 110.847 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.15 -170.18 2.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 73.03 110.95 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -117.15 124.64 49.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.277 -0.419 . . . . 74.14 110.93 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -81.35 107.98 14.58 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.552 1.157 . . . . 73.21 108.258 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 91.4 t -74.08 -28.67 23.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.024 -0.989 . . . . 74.44 111.085 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.86 -56.47 20.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 75.24 111.149 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.69 -12.36 39.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.242 -0.436 . . . . 63.24 110.916 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 6.2 t0 64.0 56.36 1.44 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 53.22 110.881 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -161.0 122.99 3.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.453 . . . . 74.14 110.931 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.7 148.64 3.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.138 -0.483 . . . . 71.43 110.943 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -147.33 -178.87 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.252 -0.431 . . . . 72.25 111.153 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 18.6 p -125.23 -175.44 3.31 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.49 1.119 . . . . 75.31 108.323 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -74.29 -36.12 63.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.057 -0.974 . . . . 70.4 111.069 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.67 -27.42 67.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 74.53 111.006 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 67.0 m -81.03 -35.11 32.29 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.447 1.092 . . . . 75.43 108.341 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -76.85 -14.96 59.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.998 -1.001 . . . . 74.43 110.911 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.5 tp -105.32 -44.93 4.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.182 -0.463 . . . . 73.11 110.926 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 45.0 t -89.67 -42.87 14.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 73.55 111.111 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.43 -142.93 1.04 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.742 -0.742 . . . . 72.34 112.453 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -129.7 24.79 5.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.84 0.352 . . . . 75.25 110.878 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -92.36 43.99 1.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 74.02 110.882 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.65 -47.08 7.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.45 . . . . 73.22 110.868 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -88.15 6.95 34.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 75.14 110.848 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 41.7 m170 -81.94 120.33 25.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 74.33 110.87 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.96 143.9 50.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.218 -0.446 . . . . 72.0 110.933 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.8 m -140.92 -173.57 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 72.42 111.16 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -124.81 109.1 12.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 73.2 111.122 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -83.81 124.47 30.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.283 -0.417 . . . . 70.01 111.064 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 4.6 tp -126.94 140.68 52.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.477 . . . . 72.03 110.884 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 4.1 t -154.68 121.19 5.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 74.31 110.863 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.106 -0.497 . . . . 55.32 110.876 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 17.5 p . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.908 0.385 . . . . 73.41 110.843 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 11.4 t60 -86.85 109.13 19.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 74.03 110.859 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 17.0 tt -148.89 142.84 18.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 74.21 111.185 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -126.61 144.34 50.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.193 -0.458 . . . . 73.14 110.842 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -105.46 121.99 7.03 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.742 -0.742 . . . . 75.11 112.524 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -86.49 140.41 29.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.749 0.309 . . . . 73.12 110.956 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -110.0 175.5 5.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.277 -0.42 . . . . 64.23 110.93 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -59.87 165.19 3.32 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.505 1.128 . . . . 54.42 108.306 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.28 -52.82 12.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.003 -0.999 . . . . 75.14 110.824 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -84.12 -37.39 22.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 73.41 110.817 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 27.5 m80 -87.48 120.09 28.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 74.23 110.845 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -98.66 -31.65 11.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 72.44 110.892 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -95.88 34.59 1.5 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.486 . . . . 75.22 110.883 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -153.48 90.3 1.4 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 73.02 110.935 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -57.33 147.32 26.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.446 . . . . 75.45 110.92 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 21.8 m -51.86 171.11 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.273 -0.421 . . . . 70.13 111.172 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -132.45 -39.39 1.02 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.213 -0.449 . . . . 74.22 110.897 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.07 -169.95 1.99 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 73.02 110.88 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -123.32 124.88 43.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.261 -0.427 . . . . 74.44 110.921 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.99 110.22 18.26 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.482 1.114 . . . . 62.33 108.366 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 62.0 t -75.3 -40.71 43.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 114.95 -1.023 . . . . 75.31 111.081 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 3.4 t -51.68 -44.61 63.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 72.31 111.117 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -97.49 -16.28 20.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.45 . . . . 73.01 110.774 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 9.4 t0 63.88 58.08 1.27 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.245 -0.434 . . . . 75.12 110.869 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -163.5 121.19 1.87 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.22 -0.446 . . . . 74.11 110.943 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.86 148.77 3.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.256 -0.429 . . . . 74.3 110.861 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.1 pp -144.55 -179.49 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 74.03 111.132 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.9 p -128.02 -175.56 3.53 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.47 1.106 . . . . 74.32 108.368 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.57 -34.02 67.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.027 -0.988 . . . . 62.32 111.027 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.18 -20.54 63.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 71.52 110.989 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 4.5 m -81.18 -35.52 31.31 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.538 1.149 . . . . 42.12 108.29 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -76.83 -14.88 59.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.07 -0.968 . . . . 75.42 110.866 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 tp -105.23 -44.92 4.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.247 -0.433 . . . . 72.22 110.93 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 43.3 t -89.65 -43.01 14.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.22 -0.445 . . . . 74.4 111.143 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -74.48 -142.07 0.75 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.742 -0.742 . . . . 73.11 112.429 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 11.3 mtp180 -128.87 24.09 5.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.875 0.369 . . . . 73.42 110.883 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -94.59 38.27 1.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 73.25 110.901 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -94.09 -34.18 13.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 72.1 110.865 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -104.99 7.3 34.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 72.14 110.837 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -79.72 -175.88 5.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.834 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.09 143.86 45.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.456 . . . . 74.24 110.958 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 31.4 m -143.12 -176.39 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.233 -0.44 . . . . 74.44 111.169 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -120.93 105.4 10.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 74.01 111.071 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -92.41 -178.8 5.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.206 -0.452 . . . . 75.31 111.105 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.83 171.49 14.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.24 -0.437 . . . . 75.45 110.849 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.73 -175.32 2.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.113 -0.494 . . . . 73.44 110.848 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.106 -0.497 . . . . 75.41 110.917 -179.978 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 2.8 t . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.898 0.38 . . . . 73.23 110.851 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -120.43 55.11 1.03 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 72.24 110.889 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 58.5 mt -110.65 -59.47 3.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 75.21 111.092 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 62.75 179.36 0.14 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.192 -0.458 . . . . 75.13 110.874 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 145.32 -128.82 3.26 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.711 -0.757 . . . . 74.01 112.478 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 1.5 mp -120.21 89.66 3.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.793 0.33 . . . . 72.13 110.907 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.52 -170.15 1.59 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.216 -0.447 . . . . 74.14 110.882 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -93.86 163.18 13.61 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.521 1.138 . . . . 74.01 108.318 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.97 -53.01 22.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.031 -0.986 . . . . 73.21 110.886 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.36 -36.81 22.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 75.34 110.891 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 48.3 m80 -89.29 88.34 7.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.133 -0.485 . . . . 74.32 110.882 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.31 -23.99 46.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 74.45 110.918 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -95.4 34.57 1.43 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.097 -0.501 . . . . 74.24 110.888 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -152.3 172.83 15.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 74.14 110.884 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.11 139.11 53.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.097 -0.502 . . . . 75.13 110.834 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 8.1 m -50.9 169.3 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 73.01 111.15 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -130.39 -43.09 1.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 74.44 110.857 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -154.46 -172.81 4.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 74.33 110.853 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -124.07 127.76 48.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.28 -0.418 . . . . 75.23 110.905 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -82.07 107.21 14.59 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.513 1.133 . . . . 52.31 108.3 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 40.2 t -73.71 -26.76 22.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 114.994 -1.003 . . . . 72.43 111.125 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -56.16 21.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.226 -0.443 . . . . 73.34 111.131 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.32 -12.39 37.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 73.23 110.869 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 1.9 t70 64.27 58.61 1.1 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 65.35 110.874 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -159.22 118.35 2.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 72.05 110.85 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.74 148.83 3.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 71.53 110.856 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -147.41 -179.87 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.452 . . . . 73.04 111.144 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 23.3 p -123.46 -175.68 3.26 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.445 1.091 . . . . 64.35 108.339 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -71.82 -34.3 69.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.992 -1.004 . . . . 64.52 111.104 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.5 -20.5 63.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 75.43 110.928 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 8.1 m -80.87 -35.99 31.91 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.477 1.11 . . . . 61.14 108.312 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 33.4 mtmt -77.17 -14.35 59.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.004 -0.998 . . . . 75.53 110.921 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.1 tp -105.14 -44.61 4.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.239 -0.437 . . . . 74.15 110.962 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 44.1 t -89.68 -42.86 14.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.187 -0.46 . . . . 74.04 111.096 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.79 -140.67 0.91 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.72 -0.752 . . . . 74.54 112.47 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 80.0 mtm180 -132.51 22.78 4.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.853 0.359 . . . . 75.2 110.896 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -96.95 38.64 1.22 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.179 -0.464 . . . . 73.23 110.832 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 4.3 ttt85 -94.25 -43.95 8.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 74.22 110.839 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -93.71 7.13 45.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 73.35 110.812 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.8 m170 -79.78 174.84 11.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 75.15 110.852 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -93.41 143.79 25.95 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.193 -0.458 . . . . 74.52 110.881 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 29.9 m -150.32 -175.03 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 75.14 111.167 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -140.87 -169.84 2.9 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.211 -0.45 . . . . 74.01 111.073 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -142.08 -173.42 3.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 43.41 111.122 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -126.51 106.57 9.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.188 -0.46 . . . . 75.15 110.967 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.84 159.26 15.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 71.41 110.842 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 . . . . . 0 C--N 1.331 -0.232 0 CA-C-N 116.077 -0.51 . . . . 74.32 110.837 179.995 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.896 0.379 . . . . 63.52 110.899 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 4.4 m170 -97.27 -28.74 13.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.166 -0.47 . . . . 73.34 110.807 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 1.1 pp -54.16 -28.13 17.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.214 -0.448 . . . . 73.2 111.126 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.64 129.6 33.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.124 -0.489 . . . . 72.15 110.888 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 159.7 -51.21 0.38 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.761 -0.733 . . . . 72.31 112.538 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 14.3 tp 63.53 106.22 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.821 0.343 . . . . 74.23 110.875 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.06 174.45 5.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 63.41 110.826 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -55.02 163.28 1.07 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.544 1.153 . . . . 74.12 108.34 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.82 -54.69 10.65 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.048 -0.978 . . . . 75.25 110.917 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -84.22 -36.88 22.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 75.21 110.941 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 10.0 m170 -88.93 64.2 7.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 74.4 110.833 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -24.52 52.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 74.02 110.896 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -95.54 34.71 1.43 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 73.31 110.775 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -154.71 103.48 2.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 74.41 110.96 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.5 151.98 9.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 74.32 110.94 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 27.6 m -69.67 172.15 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.457 . . . . 63.24 111.073 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -129.46 -45.55 1.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 71.01 110.892 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.11 -170.1 3.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 72.2 110.895 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -123.59 129.25 50.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 74.24 110.902 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -85.78 106.4 17.0 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.548 1.155 . . . . 73.13 108.264 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 99.7 t -75.01 -39.89 44.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 114.948 -1.024 . . . . 71.32 111.127 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 1.2 t -51.34 -39.18 56.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 74.22 111.107 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -106.75 -9.5 16.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.296 -0.411 . . . . 63.2 110.841 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 5.7 t70 61.43 55.2 2.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 75.54 110.868 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.65 127.5 6.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 75.24 110.876 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.89 152.36 2.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.214 -0.448 . . . . 74.4 110.906 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -146.29 143.25 21.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.193 -0.458 . . . . 73.5 111.124 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 14.8 p -101.09 -175.4 2.86 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.554 1.159 . . . . 72.21 108.343 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -71.3 -41.28 70.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.062 -0.972 . . . . 73.33 111.11 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.23 -25.35 61.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.288 -0.414 . . . . 73.04 110.919 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 62.9 m -81.22 -33.83 32.6 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.449 1.093 . . . . 64.24 108.301 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.38 -16.07 59.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.045 -0.979 . . . . 73.14 110.941 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.7 tp -105.68 -45.67 4.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 64.23 110.897 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 42.1 t -89.66 -43.21 14.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 73.51 111.192 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -72.86 -149.3 1.04 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.745 -0.74 . . . . 64.05 112.509 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.21 22.5 4.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.818 0.342 . . . . 75.33 110.843 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -90.04 47.94 1.51 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 64.3 110.901 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -94.07 -49.41 5.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 73.42 110.91 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -82.12 0.48 40.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.466 . . . . 75.24 110.864 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 38.6 m170 -79.85 120.9 24.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.252 -0.431 . . . . 72.22 110.821 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.53 153.9 18.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 74.31 110.931 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.5 m -147.7 -172.99 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 73.43 111.136 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -128.03 107.17 9.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 74.24 111.103 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -84.4 130.65 34.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.199 -0.455 . . . . 63.21 111.096 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 3.7 mp -77.2 171.78 14.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 72.44 110.899 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.2 t -175.88 114.39 0.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 75.33 110.889 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.109 -0.496 . . . . 73.44 110.91 179.987 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.983 0.421 . . . . 72.34 110.888 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -124.13 148.98 46.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.109 -0.496 . . . . 73.24 110.892 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 2.6 mp -119.57 -61.63 2.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 73.54 111.128 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 4.7 mtp180 -67.14 164.47 17.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.19 -0.459 . . . . 71.44 110.875 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 141.62 80.52 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.768 -0.73 . . . . 71.2 112.442 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 92.0 mt -133.16 77.57 1.74 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.79 0.329 . . . . 74.05 110.832 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -78.87 -173.07 3.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 75.31 110.811 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -77.01 162.0 27.89 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.566 1.166 . . . . 63.34 108.272 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.7 mp -71.62 -50.65 28.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.964 -1.017 . . . . 74.54 110.97 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -84.14 -38.74 20.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.183 -0.462 . . . . 75.32 110.894 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -88.49 110.85 21.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 73.22 110.9 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -90.4 -32.99 16.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 61.41 110.915 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -95.23 34.78 1.37 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.074 -0.512 . . . . 74.1 110.862 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.32 106.54 2.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 75.12 110.881 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 8.2 mtpp -72.48 149.4 44.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.505 . . . . 73.01 110.882 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 12.6 m -51.24 169.51 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.243 -0.435 . . . . 75.33 111.135 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -127.74 -38.76 1.85 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 73.5 110.909 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.3 -170.04 1.97 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 73.23 110.836 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -118.46 127.98 54.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 75.1 110.881 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -82.13 108.47 15.63 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.561 1.163 . . . . 72.21 108.248 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 61.6 t -73.81 -27.39 22.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 114.994 -1.003 . . . . 73.31 111.142 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.32 -55.78 24.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 74.51 111.113 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.58 -11.27 40.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.436 . . . . 63.13 110.842 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 18.4 t0 63.63 54.15 1.92 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 75.14 110.803 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -157.73 126.07 5.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.246 -0.434 . . . . 73.11 110.881 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.13 150.91 4.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 74.23 110.924 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.7 pp -149.88 -179.4 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 74.43 111.107 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 17.5 p -126.78 -175.63 3.46 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.431 1.082 . . . . 70.22 108.294 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -73.12 -38.24 66.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.064 -0.971 . . . . 74.13 111.145 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -27.43 65.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 74.32 110.969 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 67.6 m -81.01 -34.07 33.18 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.514 1.134 . . . . 74.43 108.3 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -76.22 -15.42 60.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.977 -1.01 . . . . 75.4 110.911 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.73 -45.54 4.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 75.13 110.92 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 53.5 t -89.64 -43.0 14.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.158 -0.474 . . . . 63.23 111.143 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.58 -146.55 0.93 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.667 -0.778 . . . . 70.22 112.469 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 53.2 ttt180 -128.12 24.68 5.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.771 0.32 . . . . 75.23 110.884 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 62.2 m-70 -94.12 39.91 1.08 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 74.21 110.856 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 7.7 ttm-85 -87.34 -45.66 10.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 74.42 110.856 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -89.57 5.53 45.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.178 -0.465 . . . . 72.42 110.854 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 41.5 m170 -81.04 120.17 24.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.218 -0.446 . . . . 71.24 110.882 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.94 143.89 50.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 72.34 110.875 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 19.0 m -140.37 -173.58 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 73.04 111.098 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -117.48 102.69 9.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 73.5 111.117 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -89.03 93.34 9.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 75.34 111.106 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 1.3 tp 63.07 177.98 0.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 73.41 110.938 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 6.1 m -82.67 127.22 33.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.459 . . . . 75.25 110.839 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.141 -0.482 . . . . 73.32 110.893 179.986 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 49.1 m . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.891 0.377 . . . . 65.32 110.919 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 62.2 m80 -136.29 90.89 2.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 73.42 110.85 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 63.4 mt -121.92 94.51 2.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.19 -0.459 . . . . 71.02 111.124 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 4.6 mtt180 -97.1 38.1 1.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 73.02 110.834 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -79.75 141.44 23.57 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.714 -0.755 . . . . 72.51 112.568 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.35 100.16 5.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.813 0.34 . . . . 74.11 110.916 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.21 -173.23 2.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 75.31 110.923 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -75.98 161.19 29.12 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.505 1.128 . . . . 75.24 108.307 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 10.6 mp -70.63 -51.74 25.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.027 -0.988 . . . . 73.42 110.989 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -84.03 -35.23 23.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.458 . . . . 64.33 110.899 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 22.6 m80 -94.64 93.74 7.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.106 -0.497 . . . . 70.13 110.859 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.03 -23.81 38.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.459 . . . . 74.01 110.857 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -95.44 34.62 1.43 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 75.04 110.872 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.75 112.98 1.94 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 72.21 110.894 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 14.4 pttt -72.11 146.08 47.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 71.05 110.882 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 31.6 m -51.94 171.25 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.197 -0.456 . . . . 72.21 111.147 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -132.33 -38.72 1.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.169 -0.469 . . . . 73.14 110.89 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -158.61 -170.1 2.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 73.33 110.884 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -129.0 128.11 43.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 74.3 110.878 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -83.64 109.78 17.73 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.431 1.082 . . . . 74.43 108.294 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 39.6 t -75.27 -42.19 43.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 114.961 -1.018 . . . . 75.43 111.068 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 3.5 t -51.69 -44.14 63.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 74.33 111.113 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -97.5 -14.95 20.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 73.14 110.868 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.85 56.54 1.86 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 63.54 110.847 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -158.77 120.36 3.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.465 . . . . 75.44 110.927 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.25 148.91 5.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 72.24 110.875 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -144.88 -179.77 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.19 -0.459 . . . . 71.33 111.072 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.1 p -126.82 -175.52 3.43 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.592 1.183 . . . . 75.24 108.34 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.87 -32.68 65.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.002 -0.999 . . . . 60.31 111.077 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.86 -21.09 62.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 73.24 110.955 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 6.8 m -81.17 -35.35 31.55 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.485 1.116 . . . . 75.21 108.333 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? -76.96 -14.69 59.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.987 -1.006 . . . . 72.21 110.945 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.2 tp -105.38 -44.82 4.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 73.43 110.878 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 44.1 t -89.71 -42.91 14.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 74.54 111.131 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.54 -142.45 1.02 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.78 -0.724 . . . . 60.51 112.467 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 5.2 mtt85 -132.38 23.27 4.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.879 0.371 . . . . 71.33 110.881 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -94.55 38.36 1.11 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.162 -0.472 . . . . 74.44 110.825 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -94.22 -42.46 8.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.246 -0.433 . . . . 74.43 110.809 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -94.85 7.19 46.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.222 -0.444 . . . . 73.12 110.874 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.3 m170 -79.84 176.13 10.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 64.02 110.857 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.91 143.94 26.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 74.13 110.889 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 32.8 m -150.24 -175.61 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 73.52 111.198 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -143.21 106.93 4.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 72.1 111.072 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -76.63 137.39 39.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.259 -0.428 . . . . 75.23 111.126 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.92 164.39 14.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 73.41 110.885 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 68.7 m -111.06 47.16 1.01 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 64.41 110.885 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.142 -0.481 . . . . 62.45 110.852 -179.971 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 3.2 t . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.957 0.408 . . . . 72.22 110.862 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 3.6 p80 -119.71 39.08 3.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.065 -0.516 . . . . 71.24 110.837 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 58.4 mt -108.62 -28.72 2.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 71.42 111.097 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 41.9 mtt180 54.46 90.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 73.42 110.889 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 159.36 -161.57 32.2 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.737 -0.744 . . . . 74.01 112.508 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -143.61 46.56 1.48 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.812 0.339 . . . . 73.21 110.895 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -105.23 -174.0 2.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 71.23 110.937 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -81.36 160.96 23.98 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.481 1.113 . . . . 74.45 108.269 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.0 mp -76.43 -45.96 29.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.927 -1.033 . . . . 63.5 110.944 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -84.4 -34.79 23.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 73.31 110.854 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -99.44 78.49 2.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.137 -0.483 . . . . 75.22 110.878 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -62.74 -31.1 71.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.235 -0.438 . . . . 75.31 110.919 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -94.31 34.72 1.25 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.171 -0.468 . . . . 63.44 110.806 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.69 112.83 3.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.279 -0.418 . . . . 63.2 110.916 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 18.3 mtpt -72.51 144.62 47.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.185 -0.461 . . . . 73.43 110.845 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 29.3 m -51.51 170.56 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.19 -0.459 . . . . 74.44 111.18 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -131.85 -38.71 1.12 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.449 . . . . 63.04 110.912 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.69 -170.03 2.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.197 -0.456 . . . . 74.32 110.868 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -128.54 127.98 43.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 75.14 110.949 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -83.72 109.84 17.82 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.45 1.094 . . . . 70.51 108.265 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 22.0 t -75.23 -42.11 44.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 114.939 -1.028 . . . . 75.41 111.132 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 3.5 t -51.69 -44.07 63.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 72.42 111.154 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -97.56 -15.03 20.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.157 -0.474 . . . . 74.12 110.843 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 62.85 56.54 1.86 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.189 -0.46 . . . . 72.22 110.913 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -159.04 120.25 3.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 74.41 110.917 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.17 148.87 5.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 75.51 110.905 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -145.37 -179.63 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 75.02 111.099 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 25.6 p -126.74 -175.55 3.44 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.544 1.153 . . . . 72.21 108.317 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.81 -33.03 65.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.97 -1.014 . . . . 75.32 111.131 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.43 -20.98 62.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.45 . . . . 75.1 110.947 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 7.7 m -81.26 -35.44 31.16 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.52 1.138 . . . . 74.22 108.288 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 26.0 mtmt -77.02 -14.77 59.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.99 -1.004 . . . . 75.33 110.886 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.3 tp -105.18 -44.7 4.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.232 -0.44 . . . . 74.22 110.938 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 44.3 t -89.71 -42.81 14.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 72.14 111.075 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.96 -141.64 1.06 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.733 -0.746 . . . . 72.13 112.455 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 58.2 mtp180 -132.65 23.62 4.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.806 0.336 . . . . 73.25 110.819 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -94.78 37.95 1.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.235 -0.439 . . . . 70.52 110.894 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -94.14 -42.06 9.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.25 -0.432 . . . . 75.24 110.865 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 13.4 p-10 -95.34 7.14 47.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 64.12 110.895 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -79.79 177.16 9.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 74.2 110.913 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -96.99 143.94 27.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 73.13 110.932 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 34.5 m -150.4 -175.99 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 63.43 111.128 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -135.68 119.27 17.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 71.34 111.083 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -95.62 113.47 25.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 72.12 111.111 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.86 158.56 33.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.281 -0.418 . . . . 73.32 110.893 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.92 146.32 45.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.451 . . . . 73.0 110.873 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.462 . . . . 73.44 110.9 -179.977 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.91 0.386 . . . . 63.33 110.883 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 10.5 m-70 -100.82 -50.55 3.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 74.4 110.869 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 10.5 pt -126.0 146.83 31.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.155 -0.475 . . . . 63.32 111.106 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.92 146.23 40.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 74.53 110.846 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 148.24 -35.88 1.13 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.724 -0.75 . . . . 64.3 112.513 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 1.9 tp 63.54 106.4 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.844 0.354 . . . . 73.32 110.937 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.04 -169.93 1.56 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.265 -0.425 . . . . 75.05 110.833 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.39 160.93 25.21 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.445 1.091 . . . . 75.1 108.283 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 2.5 mp -66.3 -55.29 16.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.984 -1.007 . . . . 73.23 110.929 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -84.35 -33.73 23.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.249 -0.432 . . . . 74.34 110.895 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -94.6 75.01 3.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 74.1 110.832 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -25.42 67.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 73.44 110.895 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.55 34.6 1.45 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.107 -0.497 . . . . 73.24 110.86 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -130.47 -172.61 2.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 73.52 110.916 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.9 mttp -136.95 120.88 17.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.226 -0.443 . . . . 70.43 110.896 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 19.8 m -51.31 165.03 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 72.33 111.183 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -134.05 -50.87 0.83 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 64.13 110.844 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.88 -170.1 3.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.187 -0.46 . . . . 74.13 110.932 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -127.12 129.56 48.16 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.323 -0.398 . . . . 73.3 110.951 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.33 105.31 14.18 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.477 1.111 . . . . 73.42 108.24 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 58.8 t -73.27 -26.16 22.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 114.966 -1.015 . . . . 74.45 111.12 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.6 -55.79 20.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 71.32 111.198 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -89.76 -10.32 46.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 54.15 110.866 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 6.1 t70 64.15 58.25 1.17 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.177 -0.465 . . . . 63.0 110.862 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -160.22 127.13 4.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 72.53 110.893 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.35 152.64 2.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 74.34 110.962 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -144.84 142.77 22.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 73.33 111.087 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 14.8 p -107.12 -174.32 2.51 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.475 1.109 . . . . 72.23 108.31 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.37 -44.45 78.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.032 -0.985 . . . . 72.41 111.088 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -20.35 62.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.449 . . . . 75.04 110.914 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 24.8 m -80.82 -32.55 35.16 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.497 1.123 . . . . 75.24 108.325 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 4.5 mtpm? -77.34 -15.85 59.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.027 -0.988 . . . . 75.13 110.9 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.6 tp -105.38 -44.85 4.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.463 . . . . 61.03 110.912 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 61.5 t -89.82 -42.57 14.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.215 -0.448 . . . . 73.54 111.118 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -78.25 -148.79 3.89 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.739 -0.743 . . . . 72.42 112.478 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 8.3 ttm180 -134.25 24.75 3.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.799 0.333 . . . . 74.03 110.841 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -95.47 38.84 1.14 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 74.01 110.858 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 3.6 ttp85 -94.22 -48.0 6.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.244 -0.434 . . . . 73.23 110.842 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -90.39 7.36 39.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 64.01 110.867 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 31.5 m170 -79.94 175.01 11.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 74.54 110.896 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 52.0 mm-40 -95.03 147.55 23.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.29 -0.414 . . . . 70.43 110.952 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 35.9 m -150.33 -176.06 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 71.52 111.128 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -121.99 101.96 7.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.46 . . . . 64.41 111.132 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -66.81 146.53 54.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 70.35 111.133 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.01 124.6 29.92 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.228 -0.442 . . . . 74.15 110.865 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 6.1 p -96.2 168.18 10.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.128 -0.487 . . . . 72.41 110.779 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 116.098 -0.501 . . . . 62.14 110.873 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.843 0.354 . . . . 72.43 110.898 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -83.92 -60.51 2.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 73.42 110.804 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 9.5 tp -59.46 133.81 24.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 75.52 111.116 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.07 -174.3 1.22 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 75.54 110.827 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 132.56 129.62 3.02 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.697 -0.763 . . . . 73.02 112.506 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -119.87 95.57 4.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.821 0.343 . . . . 74.54 110.929 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -52.18 165.25 0.23 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.161 -0.472 . . . . 75.11 110.944 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -54.9 161.26 1.66 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.494 1.121 . . . . 70.51 108.301 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.2 mp -68.63 -54.77 14.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.969 -1.014 . . . . 72.31 110.905 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -83.98 -35.43 23.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.167 -0.469 . . . . 72.32 110.926 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 16.3 m80 -93.41 62.52 3.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.122 -0.49 . . . . 74.23 110.854 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -57.82 -23.6 53.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 73.13 110.947 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.45 34.6 1.43 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.122 -0.49 . . . . 73.44 110.809 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -151.47 89.29 1.48 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 73.42 110.872 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.97 121.0 5.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.103 -0.499 . . . . 73.01 110.916 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 16.7 m -51.74 163.79 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.445 . . . . 73.0 111.129 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -117.41 -36.77 3.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.15 110.849 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -162.58 -168.54 1.85 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 71.24 110.813 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -132.52 138.64 47.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 74.04 110.905 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -74.59 116.43 15.27 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.539 1.149 . . . . 74.23 108.245 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 68.7 t -74.74 -38.47 44.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 114.972 -1.013 . . . . 73.24 111.083 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.98 -53.64 55.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 74.33 111.173 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -86.14 -10.36 54.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 72.43 110.859 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 34.2 t70 57.31 50.38 11.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 73.25 110.815 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -148.61 127.33 12.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 70.25 110.913 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.17 150.78 3.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.224 -0.444 . . . . 74.55 110.878 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -155.67 142.82 11.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.197 -0.456 . . . . 74.15 111.127 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 25.5 p -97.79 -175.02 3.05 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.488 1.118 . . . . 71.22 108.279 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.2 -33.73 67.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.934 -1.03 . . . . 71.14 111.079 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.22 -24.75 65.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.261 -0.427 . . . . 73.42 110.904 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 34.5 m -80.95 -31.69 34.82 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.499 1.124 . . . . 74.21 108.291 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 41.4 mtpt -77.16 -16.59 59.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.981 -1.009 . . . . 73.25 110.971 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.3 tp -105.48 -45.22 4.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.193 -0.458 . . . . 72.43 110.929 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 61.9 t -89.87 -42.69 14.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.451 . . . . 72.41 111.117 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -72.35 -147.37 0.71 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.706 -0.759 . . . . 70.25 112.484 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.0 21.74 6.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.838 0.352 . . . . 74.44 110.886 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -95.97 39.69 1.14 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.111 -0.495 . . . . 74.02 110.93 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -94.18 -40.89 9.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.237 -0.438 . . . . 74.31 110.901 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.37 7.15 46.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 60.13 110.792 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.8 m170 -83.19 -175.26 5.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.262 -0.426 . . . . 72.11 110.877 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -117.01 147.22 42.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 75.21 110.883 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 17.9 m -139.71 -173.21 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.452 . . . . 74.44 111.15 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -105.92 -169.43 1.58 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 72.25 111.098 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -154.84 144.88 21.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 74.23 111.058 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.97 169.85 9.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.446 . . . . 74.21 110.938 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 94.6 p -155.05 146.26 22.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 73.12 110.825 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 73.23 110.843 179.979 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 27.7 t . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.888 0.375 . . . . 75.31 110.885 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.3 135.65 55.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 71.21 110.856 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 4.3 pt -135.67 71.46 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 75.23 111.133 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 63.14 95.13 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.217 -0.447 . . . . 74.25 110.889 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 158.41 90.49 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.732 -0.747 . . . . 54.33 112.494 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.56 104.92 13.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.821 0.343 . . . . 74.23 110.926 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -52.08 154.96 2.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.46 . . . . 70.0 110.829 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.3 164.17 1.01 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.521 1.138 . . . . 73.41 108.33 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.4 mp -77.02 -48.03 19.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.98 -1.009 . . . . 75.34 110.918 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -84.17 -43.27 15.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 72.21 110.858 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 20.7 m80 -89.77 62.11 5.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 75.21 110.869 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -52.24 -29.77 24.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.177 -0.465 . . . . 73.24 110.912 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -93.91 35.01 1.17 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 62.32 110.913 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.77 96.57 2.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 75.35 110.872 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.48 126.38 27.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 73.1 110.902 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 16.8 m -51.77 163.34 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.434 . . . . 74.43 111.102 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -118.96 -37.41 3.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 71.11 110.878 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.21 -168.45 2.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 73.31 110.831 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -132.71 138.69 47.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 72.21 110.947 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.65 113.75 10.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.575 1.172 . . . . 64.2 108.359 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 60.5 t -74.21 -28.67 23.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.003 -0.998 . . . . 72.53 111.107 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.73 -56.34 16.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.453 . . . . 65.44 111.141 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.36 -4.59 55.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.246 -0.434 . . . . 72.41 110.843 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 6.2 t70 57.05 50.64 11.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 73.03 110.862 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.52 127.41 17.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 74.21 110.929 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.64 150.67 3.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.162 -0.472 . . . . 74.43 110.919 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -156.45 142.57 10.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 74.35 111.163 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 20.8 p -97.47 -175.1 3.1 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.434 1.084 . . . . 72.33 108.31 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.02 -35.9 69.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.971 -1.013 . . . . 60.4 111.081 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.98 -24.71 67.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 72.15 110.883 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 37.0 m -81.08 -32.39 33.97 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.422 1.076 . . . . 64.1 108.27 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 30.9 mtmt -76.45 -16.53 59.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.99 -1.005 . . . . 73.42 110.842 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.3 tp -105.74 -45.51 4.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 74.43 110.939 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 53.0 t -89.73 -42.93 14.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.16 -0.473 . . . . 74.41 111.197 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -71.79 -149.2 0.76 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.743 -0.742 . . . . 64.02 112.462 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.52 20.7 6.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.808 0.337 . . . . 74.24 110.874 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -96.71 39.38 1.17 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 74.33 110.907 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.08 -47.94 6.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 73.22 110.882 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.76 2.03 39.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.223 -0.444 . . . . 75.32 110.891 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 36.3 m170 -79.98 -176.46 5.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 74.5 110.876 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.09 144.61 42.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.196 -0.456 . . . . 73.4 110.884 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.9 m -135.57 -175.23 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.205 -0.452 . . . . 72.44 111.124 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -107.91 79.98 1.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.097 -0.501 . . . . 75.41 111.038 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -93.78 119.73 33.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.281 -0.418 . . . . 75.32 111.074 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 59.15 -177.1 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 74.21 110.891 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -163.44 107.9 1.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 73.2 110.856 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.16 -0.473 . . . . 71.0 110.831 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 17.9 m . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.888 0.375 . . . . 62.33 110.836 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 59.3 m-70 -98.22 135.64 39.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 72.21 110.843 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 2.1 pt -133.25 37.4 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.444 . . . . 75.42 111.142 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.8 -27.53 30.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 73.31 110.853 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -59.47 124.39 36.27 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.809 -0.71 . . . . 72.44 112.521 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.33 98.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.901 0.382 . . . . 73.23 110.931 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.93 166.4 0.15 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 71.12 110.862 179.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -61.75 162.01 9.3 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.496 1.122 . . . . 73.02 108.271 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 3.9 mp -68.25 -53.1 26.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.98 -1.009 . . . . 73.25 110.94 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -84.27 -35.39 23.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 65.44 110.879 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -91.98 71.03 5.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 70.13 110.884 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -24.36 67.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.203 -0.453 . . . . 71.05 110.914 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -95.44 34.73 1.41 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.481 . . . . 75.41 110.77 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.1 -169.3 2.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 74.35 110.892 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 9.7 tttt -140.71 127.61 20.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.485 . . . . 73.42 110.855 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 3.3 m -50.61 167.81 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 71.51 111.081 179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 39.6 t-20 -127.82 -38.08 1.89 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 73.43 110.856 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 1.2 mmt -164.17 -171.63 2.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 71.32 110.863 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -117.07 126.93 53.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.216 -0.447 . . . . 71.53 110.954 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -83.43 107.06 15.68 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.45 1.094 . . . . 73.24 108.281 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 60.4 t -75.49 -41.27 42.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.011 -0.995 . . . . 64.13 111.1 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 1.2 t -50.49 -34.76 26.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.476 . . . . 71.34 111.079 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -111.73 -9.44 14.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.266 -0.424 . . . . 54.52 110.827 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 9.2 t0 60.23 55.18 3.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 72.23 110.935 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -158.37 125.99 5.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.126 -0.488 . . . . 73.43 110.942 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.1 149.18 19.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.457 . . . . 73.32 110.904 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -150.32 -179.28 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 74.01 111.119 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 27.6 p -123.51 -175.51 3.22 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.509 1.131 . . . . 64.11 108.225 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -73.29 -32.28 64.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.983 -1.008 . . . . 70.52 111.06 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.64 -25.5 67.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 74.32 110.951 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 57.8 m -81.03 -35.45 31.86 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 124.568 1.168 . . . . 72.32 108.311 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 4.0 mtmt -76.91 -14.76 59.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.976 -1.011 . . . . 71.31 110.869 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.8 tp -105.38 -45.0 4.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.266 -0.425 . . . . 74.13 110.903 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 43.6 t -89.64 -43.0 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 74.51 111.122 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.94 -142.28 0.67 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.715 -0.755 . . . . 70.43 112.478 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -128.26 23.17 6.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.766 0.317 . . . . 72.44 110.896 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 -97.86 39.56 1.21 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.162 -0.472 . . . . 75.41 110.898 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -84.48 -40.51 17.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 71.2 110.859 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -97.95 7.05 46.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 65.3 110.905 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.3 m170 -80.5 120.48 24.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 74.14 110.813 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -59.64 163.66 4.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 73.03 110.913 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 14.0 m -149.11 -176.32 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 73.01 111.137 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -105.86 39.73 1.72 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.2 -0.455 . . . . 65.1 111.138 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -69.24 131.24 44.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 74.23 111.091 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 2.8 mp -74.6 170.81 15.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 74.21 110.947 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.3 p -100.78 175.59 5.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.211 -0.449 . . . . 71.02 110.855 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 72.54 110.916 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.941 0.4 . . . . 64.34 110.802 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 33.5 p80 -102.58 -28.55 12.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.067 -0.515 . . . . 74.32 110.824 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 1.9 mp 70.99 -70.41 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.439 . . . . 74.44 111.072 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -120.44 -50.68 2.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 74.4 110.877 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 134.2 166.99 11.4 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.748 -0.739 . . . . 75.41 112.452 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.31 73.58 0.89 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.796 0.332 . . . . 75.42 110.926 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.44 -169.48 1.47 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 74.13 110.888 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.32 161.59 16.28 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.499 1.124 . . . . 73.0 108.31 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.76 -53.26 34.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.008 -0.996 . . . . 75.31 110.946 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -84.62 -36.35 22.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 73.24 110.869 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 34.0 m80 -91.47 88.94 7.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 64.32 110.776 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -78.5 -25.46 45.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 71.51 110.86 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -95.5 34.58 1.44 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 74.5 110.896 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -141.3 179.57 6.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 75.32 110.908 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.14 128.34 41.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 73.34 110.88 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 22.8 m -50.81 168.0 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.157 -0.474 . . . . 74.41 111.165 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -127.6 -38.49 1.9 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.258 -0.428 . . . . 72.34 110.893 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -164.52 -170.15 1.96 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 72.11 110.831 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -120.11 127.4 52.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 72.21 110.956 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -80.67 108.05 13.99 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.446 1.091 . . . . 53.34 108.268 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 53.1 t -73.8 -28.49 24.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 114.955 -1.02 . . . . 64.54 111.191 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -55.6 28.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.133 -0.485 . . . . 75.54 111.191 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.5 -11.31 40.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 74.15 110.84 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 4.8 t70 63.51 55.05 1.82 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 75.43 110.889 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -157.39 125.12 5.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 72.52 110.88 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.86 148.87 6.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.24 -0.436 . . . . 72.34 110.864 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.2 pp -147.24 -179.88 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 71.4 111.133 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 22.1 p -126.97 -175.67 3.49 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.465 1.103 . . . . 73.13 108.291 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -71.89 -34.68 69.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.992 -1.004 . . . . 74.41 111.123 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -23.69 67.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 73.04 110.942 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 51.7 m -80.97 -36.08 31.3 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.54 1.15 . . . . 73.41 108.317 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.74 -14.7 59.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.939 -1.028 . . . . 75.32 110.929 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.4 tp -105.19 -44.99 4.62 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.213 -0.448 . . . . 74.43 110.89 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 42.1 t -89.54 -43.08 14.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 74.14 111.104 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.71 -142.41 1.07 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.753 -0.737 . . . . 70.02 112.517 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 3.3 mtp85 -132.98 24.77 4.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.831 0.348 . . . . 74.55 110.827 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 50.1 m-70 -93.8 40.73 1.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 74.03 110.832 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 9.3 ptt85 -89.07 -39.74 13.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.277 -0.42 . . . . 71.41 110.875 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -94.8 3.8 54.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.199 -0.455 . . . . 73.1 110.851 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 48.5 m170 -79.95 120.18 23.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 74.3 110.855 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.84 143.89 50.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 62.22 110.891 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.7 m -139.69 -173.4 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.475 . . . . 71.54 111.089 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -123.46 113.53 18.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.231 -0.44 . . . . 74.42 111.097 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -71.68 152.96 42.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.273 -0.421 . . . . 74.15 111.066 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.26 142.19 45.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 75.14 110.878 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.5 p -165.27 133.89 3.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.116 -0.493 . . . . 74.41 110.852 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 63.4 110.925 -179.98 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 39.9 m . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.936 0.398 . . . . 71.31 110.859 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 33.8 p-80 -126.27 39.89 3.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 73.54 110.826 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 20.1 tt -115.88 -26.88 2.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.213 -0.448 . . . . 74.25 111.085 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 38.6 ttp85 -62.52 124.61 21.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 65.52 110.873 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -141.17 -167.75 11.22 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.765 -0.731 . . . . 74.12 112.524 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.34 102.29 11.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.851 0.358 . . . . 75.44 110.936 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.21 -171.57 1.86 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 75.11 110.861 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -95.05 160.98 14.32 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 75.01 108.267 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.25 -55.63 20.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.961 -1.018 . . . . 73.01 110.883 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -84.56 -33.63 23.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.429 . . . . 73.21 110.859 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -94.96 65.85 2.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.476 . . . . 74.31 110.872 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.64 -28.48 67.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.435 . . . . 64.4 110.9 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -93.23 35.1 1.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 64.1 110.843 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -135.54 175.31 9.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 73.14 110.883 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.63 113.55 13.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 74.11 110.92 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 16.0 m -51.43 160.94 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.424 . . . . 75.11 111.151 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -122.87 -39.21 2.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 74.42 110.826 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.26 -169.4 3.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.471 . . . . 71.11 110.845 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -133.31 138.84 46.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.224 -0.444 . . . . 71.25 110.894 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.66 114.79 12.31 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.495 1.122 . . . . 75.45 108.274 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 20.7 t -74.29 -30.53 26.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 114.992 -1.004 . . . . 73.43 111.145 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.58 -56.08 21.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 73.55 111.18 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.59 -5.2 56.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.265 -0.425 . . . . 74.21 110.921 179.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 23.8 t70 56.59 50.08 13.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 70.13 110.893 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -143.81 127.32 16.94 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.143 -0.48 . . . . 74.23 110.916 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.33 151.02 3.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 73.44 110.944 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -156.32 142.84 10.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 73.24 111.148 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.2 p -97.75 -175.19 3.1 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.524 1.14 . . . . 71.34 108.322 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.29 -32.69 66.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.0 -1.0 . . . . 60.44 111.118 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.31 -22.2 62.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.26 -0.427 . . . . 72.42 110.858 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 12.8 m -80.89 -33.6 34.16 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.446 1.091 . . . . 55.01 108.363 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -76.91 -15.6 59.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.977 -1.011 . . . . 74.53 110.9 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.9 tp -105.58 -45.15 4.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 73.24 110.879 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 48.2 t -89.66 -42.8 14.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 71.55 111.207 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.48 -145.0 0.75 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.708 -0.758 . . . . 62.42 112.474 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -129.58 21.55 5.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.79 0.328 . . . . 74.33 110.907 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -99.28 39.86 1.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.244 -0.435 . . . . 75.11 110.864 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -94.24 -48.19 6.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 73.35 110.854 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -84.54 2.87 39.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.243 -0.435 . . . . 60.24 110.899 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.0 m170 -80.22 -176.75 5.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.461 . . . . 73.12 110.854 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -112.92 151.81 30.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 74.23 110.901 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.9 m -143.01 -175.88 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.462 . . . . 75.42 111.122 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -107.68 85.1 2.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 72.5 111.064 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -75.68 132.29 40.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 64.25 111.105 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.48 150.42 23.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 71.12 110.948 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 33.3 t -130.32 128.19 41.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.451 . . . . 70.3 110.848 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 70.41 110.891 179.985 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 66.4 m . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.86 0.362 . . . . 70.54 110.888 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -152.61 -54.79 0.12 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 74.2 110.871 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 5.3 pt -110.47 72.36 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.225 -0.443 . . . . 74.21 111.064 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -133.13 148.03 52.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.434 . . . . 74.22 110.817 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -96.47 64.9 1.08 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.787 -0.721 . . . . 73.45 112.498 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.5 115.93 3.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.752 0.311 . . . . 60.12 110.881 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -52.09 155.44 1.9 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.177 -0.465 . . . . 70.23 110.892 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.92 161.0 1.76 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.505 1.128 . . . . 73.4 108.332 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 10.5 mp -73.58 -47.92 36.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.048 -0.978 . . . . 72.52 110.906 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -84.21 -42.26 16.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.213 -0.448 . . . . 74.1 110.875 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -91.89 62.11 4.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.078 -0.51 . . . . 72.34 110.828 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.44 -29.88 26.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 74.13 110.858 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -93.99 34.98 1.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.156 -0.475 . . . . 73.04 110.942 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.8 96.68 2.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.149 -0.478 . . . . 74.5 110.848 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -56.76 132.67 52.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 74.4 110.899 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 20.0 m -61.3 165.73 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 75.03 111.149 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -119.65 -35.54 3.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 74.24 110.864 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -162.43 -168.27 1.8 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 70.02 110.934 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -132.6 138.51 47.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.289 -0.414 . . . . 73.21 110.931 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.8 114.08 10.55 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.506 1.129 . . . . 72.22 108.278 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 60.1 t -74.32 -29.55 24.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 114.972 -1.013 . . . . 74.25 111.083 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -56.23 18.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 75.23 111.171 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -90.79 -5.1 56.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 74.51 110.895 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 3.7 t0 56.99 50.62 11.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 74.45 110.851 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -144.06 127.34 16.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 74.45 110.899 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.58 150.27 3.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.243 -0.435 . . . . 71.35 110.882 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -156.27 142.6 10.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.194 -0.457 . . . . 74.42 111.157 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.5 p -95.8 -175.21 3.36 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 74.44 108.279 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.31 -32.72 66.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.993 -1.003 . . . . 72.41 111.096 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.02 -24.04 64.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 74.42 110.859 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 23.4 m -81.27 -31.32 33.73 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.514 1.134 . . . . 53.42 108.336 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -76.46 -17.54 59.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.002 -0.999 . . . . 72.03 110.873 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.9 tp -105.99 -45.88 4.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 72.22 110.922 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 44.6 t -89.81 -43.3 14.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.203 -0.453 . . . . 63.43 111.106 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -67.72 -153.8 0.42 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 74.45 112.551 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -120.08 19.29 12.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.818 0.342 . . . . 73.4 110.852 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -96.26 47.49 1.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 75.24 110.861 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.11 -51.16 4.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.23 -0.441 . . . . 74.41 110.843 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.9 7.2 31.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 74.44 110.881 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 33.5 m170 -79.81 -176.41 5.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.47 . . . . 72.33 110.933 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -117.55 146.07 43.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 73.24 110.917 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.9 m -136.17 -174.51 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 72.05 111.157 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -109.34 79.84 1.26 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.454 . . . . 73.15 111.069 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -70.23 140.5 52.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.22 -0.445 . . . . 72.12 111.08 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.59 153.42 27.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 75.54 110.967 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -158.91 107.75 1.91 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 72.24 110.823 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 71.14 110.863 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 C--O 1.231 0.086 0 CA-C-O 119.344 -0.36 . . . . 64.54 110.873 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.2 161.09 29.66 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.438 1.086 . . . . 55.42 108.334 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 1.1 mp -74.1 -47.95 32.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.057 -0.974 . . . . 61.04 110.943 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.15 -36.02 23.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 75.15 110.902 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 178' ' ' HIS . . . . . 0.664 ' NE2' HD22 ' A' ' 197' ' ' LEU . 49.4 m80 -93.97 104.5 16.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.132 -0.485 . . . . 63.33 110.888 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.62 -32.83 25.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 65.23 110.869 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -94.95 34.71 1.33 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 62.01 110.845 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.635 ' OE2' HD12 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -155.71 113.08 3.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 63.42 110.885 -179.898 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.17 153.28 36.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 74.04 110.943 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 183' ' ' VAL . . . . . 0.834 HG11 HD22 ' A' ' 193' ' ' LEU . 12.7 m -53.59 174.52 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 61.14 111.14 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 55.5 t-20 -132.83 -40.86 0.94 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 73.4 110.928 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.1 -170.12 2.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 72.14 110.9 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.58 ' CE2' HG22 ' A' ' 188' ' ' VAL . 10.9 t80 -119.61 123.75 44.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 75.25 110.939 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.44 108.49 14.11 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.489 1.118 . . . . 55.33 108.35 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 188' ' ' VAL . . . . . 0.58 HG22 ' CE2' ' A' ' 186' ' ' TYR . 65.7 t -73.81 -26.79 21.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.013 -0.994 . . . . 71.12 111.123 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 189' ' ' THR . . . . . 0.725 HG23 ' HB2' ' A' ' 208' ' ' GLN . 0.8 OUTLIER -61.63 -56.73 16.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.193 -0.458 . . . . 75.33 111.181 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -89.91 -12.45 38.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.197 -0.456 . . . . 55.21 110.866 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 5.5 t0 64.33 58.67 1.08 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.209 -0.451 . . . . 52.3 110.944 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -162.52 124.39 2.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 73.51 110.92 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 193' ' ' LEU . . . . . 0.834 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.81 149.33 6.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.174 -0.466 . . . . 73.31 110.896 -179.981 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -147.87 -178.87 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 55.23 111.192 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 20.4 p -125.7 -175.29 3.3 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.549 1.156 . . . . 44.13 108.308 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -73.15 -35.84 66.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.013 -0.994 . . . . 72.21 111.064 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.664 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.2 OUTLIER -64.67 -24.16 67.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.192 -0.458 . . . . 72.31 110.894 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 30.1 m -81.17 -34.87 32.09 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.558 1.161 . . . . 73.25 108.353 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 28.3 mtmt -76.89 -14.86 59.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.036 -0.983 . . . . 74.33 110.957 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 5.7 tp -105.35 -44.86 4.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 72.13 110.922 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 201' ' ' VAL . . . . . 0.578 HG21 HD23 ' A' ' 197' ' ' LEU . 47.2 t -89.73 -42.8 14.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.2 -0.455 . . . . 72.33 111.12 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -74.89 -142.33 0.84 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.79 -0.719 . . . . 54.41 112.48 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -129.08 23.95 5.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.855 0.359 . . . . 74.51 110.859 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -95.65 37.35 1.21 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 51.41 110.876 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 10.5 ptt-85 -94.31 -32.7 13.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 74.24 110.872 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -105.03 7.23 33.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 71.15 110.844 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 51.0 m170 -79.68 174.92 11.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 65.14 110.885 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 208' ' ' GLN . . . . . 0.725 ' HB2' HG23 ' A' ' 189' ' ' THR . 0.5 OUTLIER -99.23 144.46 28.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 63.02 110.961 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 34.0 m -146.21 -175.88 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.25 -0.432 . . . . 63.43 111.14 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 73.13 111.127 179.94 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 174' ' ' MET . . . . . 0.44 ' HE1' ' HG2' ' A' ' 179' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.072 0 CA-C-O 119.277 -0.392 . . . . 71.25 110.857 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.04 161.13 20.82 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.477 1.111 . . . . 70.4 108.3 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.23 -53.47 29.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.003 -0.999 . . . . 71.42 110.882 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.4 -36.58 22.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.445 . . . . 72.12 110.863 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -91.08 90.39 7.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 74.11 110.803 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 179' ' ' GLU . . . . . 0.44 ' HG2' ' HE1' ' A' ' 174' ' ' MET . 1.2 mt-10 -86.27 4.85 37.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 74.21 110.921 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -120.03 34.69 5.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.118 -0.492 . . . . 73.4 110.859 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.88 -169.93 3.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 75.33 110.868 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.55 125.72 26.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 75.01 110.934 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 183' ' ' VAL . . . . . 0.476 ' CG1' HD22 ' A' ' 193' ' ' LEU . 31.2 m -51.48 167.64 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 53.32 111.137 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -133.05 -51.19 0.89 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 74.12 110.864 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -148.87 -172.18 4.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 73.32 110.86 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -127.48 130.67 49.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.184 -0.462 . . . . 75.5 110.937 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.64 104.75 14.0 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.447 1.092 . . . . 63.44 108.313 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 43.1 t -73.26 -27.24 23.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 114.979 -1.009 . . . . 55.15 111.132 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.31 -55.41 24.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 71.32 111.145 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.05 -10.87 45.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 75.43 110.872 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 2.4 t70 64.45 59.25 1.0 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 55.43 110.887 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -161.86 127.08 3.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 62.32 110.917 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 193' ' ' LEU . . . . . 0.476 HD22 ' CG1' ' A' ' 183' ' ' VAL . 0.2 OUTLIER -51.72 152.26 2.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 74.33 110.922 -179.986 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 194' ' ' ILE . . . . . 0.609 HD11 HG11 ' A' ' 209' ' ' VAL . 1.0 OUTLIER -144.64 142.86 23.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.444 . . . . 55.13 111.157 179.815 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 19.6 p -104.41 -175.09 2.7 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.507 1.129 . . . . 64.23 108.331 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -68.73 -39.03 80.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.024 -0.989 . . . . 72.12 111.078 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.16 -18.45 64.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 65.44 110.924 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 5.7 m -80.97 -33.48 33.82 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.524 1.14 . . . . 61.23 108.306 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.33 -15.52 59.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.978 -1.01 . . . . 64.23 110.925 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 tp -105.3 -44.75 4.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 75.04 110.887 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 49.0 t -89.85 -42.49 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 71.34 111.14 179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -77.87 -146.59 2.79 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.762 -0.733 . . . . 55.31 112.471 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -134.24 24.25 3.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.852 0.358 . . . . 75.1 110.837 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 204' ' ' HIS . . . . . 0.518 ' CG ' HG21 ' A' ' 194' ' ' ILE . 89.6 m-70 -95.99 38.68 1.17 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 71.12 110.842 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 10.3 ttm-85 -94.18 -47.69 6.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 64.02 110.878 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.49 7.14 40.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.199 -0.455 . . . . 75.14 110.83 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -79.94 174.94 11.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 74.52 110.847 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.64 143.97 25.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 75.03 110.916 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 209' ' ' VAL . . . . . 0.609 HG11 HD11 ' A' ' 194' ' ' ILE . 26.9 m -150.71 -176.22 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 74.54 111.133 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 74.13 111.087 179.915 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 119.248 -0.406 . . . . 75.42 110.879 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -72.34 163.44 27.97 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.513 1.133 . . . . 74.32 108.285 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.63 -52.44 17.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.99 -1.005 . . . . 51.23 110.901 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -84.05 -37.15 22.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 73.52 110.941 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 178' ' ' HIS . . . . . 0.624 ' NE2' HD22 ' A' ' 197' ' ' LEU . 29.3 m80 -88.66 91.71 8.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 73.54 110.882 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -26.29 53.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.239 -0.437 . . . . 72.32 110.87 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -97.93 34.41 1.91 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.232 -0.44 . . . . 65.45 110.891 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.61 ' OE2' HD12 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -156.29 113.09 3.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 70.43 110.9 -179.849 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.3 149.83 40.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 65.44 110.933 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 183' ' ' VAL . . . . . 0.835 HG11 HD22 ' A' ' 193' ' ' LEU . 15.9 m -53.59 175.17 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.289 -0.414 . . . . 55.42 111.19 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -131.04 -40.05 1.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 72.11 110.847 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.15 -170.18 2.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 71.41 110.95 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.537 ' CE2' HG22 ' A' ' 188' ' ' VAL . 14.8 t80 -117.15 124.64 49.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.277 -0.419 . . . . 74.14 110.93 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -81.35 107.98 14.58 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.552 1.157 . . . . 73.13 108.258 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 188' ' ' VAL . . . . . 0.537 HG22 ' CE2' ' A' ' 186' ' ' TYR . 91.4 t -74.08 -28.67 23.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.024 -0.989 . . . . 73.43 111.085 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.86 -56.47 20.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 72.42 111.149 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.69 -12.36 39.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.242 -0.436 . . . . 63.24 110.916 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 6.2 t0 64.0 56.36 1.44 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 53.22 110.881 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -161.0 122.99 3.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.453 . . . . 74.14 110.931 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 193' ' ' LEU . . . . . 0.835 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -50.7 148.64 3.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.138 -0.483 . . . . 64.11 110.943 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -147.33 -178.87 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.252 -0.431 . . . . 72.25 111.153 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 18.6 p -125.23 -175.44 3.31 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.49 1.119 . . . . 62.34 108.323 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -74.29 -36.12 63.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.057 -0.974 . . . . 70.4 111.069 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.624 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.3 OUTLIER -60.67 -27.42 67.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 64.15 111.006 180.0 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 67.0 m -81.03 -35.11 32.29 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.447 1.092 . . . . 52.03 108.341 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -76.85 -14.96 59.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.998 -1.001 . . . . 74.43 110.911 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.5 tp -105.32 -44.93 4.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.182 -0.463 . . . . 34.12 110.926 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 45.0 t -89.67 -42.87 14.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 73.55 111.111 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.43 -142.93 1.04 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.742 -0.742 . . . . 72.34 112.453 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -129.7 24.79 5.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.84 0.352 . . . . 61.21 110.878 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -92.36 43.99 1.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 74.02 110.882 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.65 -47.08 7.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.45 . . . . 73.22 110.868 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -88.15 6.95 34.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 75.14 110.848 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 41.7 m170 -81.94 120.33 25.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 74.33 110.87 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.96 143.9 50.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.218 -0.446 . . . . 63.22 110.933 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.8 m -140.92 -173.57 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 72.42 111.16 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 72.33 111.122 179.892 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 N--CA 1.458 -0.062 0 CA-C-O 119.24 -0.409 . . . . 61.31 110.93 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -59.87 165.19 3.32 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.505 1.128 . . . . 54.42 108.306 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.28 -52.82 12.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.003 -0.999 . . . . 75.14 110.824 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -84.12 -37.39 22.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 72.35 110.817 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 27.5 m80 -87.48 120.09 28.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 74.23 110.845 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -98.66 -31.65 11.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 64.22 110.892 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -95.88 34.59 1.5 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.486 . . . . 63.01 110.883 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.515 ' CD ' HD13 ' A' ' 197' ' ' LEU . 1.7 mp0 -153.48 90.3 1.4 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 73.02 110.935 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -57.33 147.32 26.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.446 . . . . 73.32 110.92 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 183' ' ' VAL . . . . . 0.752 HG11 HD22 ' A' ' 193' ' ' LEU . 21.8 m -51.86 171.11 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.273 -0.421 . . . . 63.3 111.172 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -132.45 -39.39 1.02 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.213 -0.449 . . . . 50.32 110.897 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.07 -169.95 1.99 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 72.32 110.88 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.679 ' CE2' HG22 ' A' ' 188' ' ' VAL . 9.0 t80 -123.32 124.88 43.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.261 -0.427 . . . . 64.32 110.921 -179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 187' ' ' CYS . . . . . 0.456 ' HA ' HG12 ' A' ' 209' ' ' VAL . 0.1 OUTLIER -83.99 110.22 18.26 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.482 1.114 . . . . 62.33 108.366 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 188' ' ' VAL . . . . . 0.679 HG22 ' CE2' ' A' ' 186' ' ' TYR . 62.0 t -75.3 -40.71 43.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 114.95 -1.023 . . . . 75.02 111.081 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 189' ' ' THR . . . . . 0.4 HG23 ' N ' ' A' ' 190' ' ' ASP . 3.4 t -51.68 -44.61 63.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 64.13 111.117 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 190' ' ' ASP . . . . . 0.4 ' N ' HG23 ' A' ' 189' ' ' THR . 11.7 m-20 -97.49 -16.28 20.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.45 . . . . 64.21 110.774 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 9.4 t0 63.88 58.08 1.27 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.245 -0.434 . . . . 72.33 110.869 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -163.5 121.19 1.87 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.22 -0.446 . . . . 71.41 110.943 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 193' ' ' LEU . . . . . 0.752 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -50.86 148.77 3.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.256 -0.429 . . . . 74.3 110.861 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.1 pp -144.55 -179.49 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 65.34 111.132 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.9 p -128.02 -175.56 3.53 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.47 1.106 . . . . 74.32 108.368 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.57 -34.02 67.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.027 -0.988 . . . . 62.32 111.027 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.515 HD13 ' CD ' ' A' ' 181' ' ' GLU . 0.5 OUTLIER -70.18 -20.54 63.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 71.52 110.989 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 4.5 m -81.18 -35.52 31.31 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.538 1.149 . . . . 42.12 108.29 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -76.83 -14.88 59.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.07 -0.968 . . . . 75.34 110.866 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 tp -105.23 -44.92 4.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.247 -0.433 . . . . 72.22 110.93 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 43.3 t -89.65 -43.01 14.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.22 -0.445 . . . . 72.41 111.143 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -74.48 -142.07 0.75 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.742 -0.742 . . . . 73.11 112.429 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 11.3 mtp180 -128.87 24.09 5.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.875 0.369 . . . . 64.51 110.883 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -94.59 38.27 1.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 73.25 110.901 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -94.09 -34.18 13.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 65.41 110.865 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -104.99 7.3 34.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 72.14 110.837 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -79.72 -175.88 5.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.834 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.09 143.86 45.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.456 . . . . 74.24 110.958 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 209' ' ' VAL . . . . . 0.456 HG12 ' HA ' ' A' ' 187' ' ' CYS . 31.4 m -143.12 -176.39 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.233 -0.44 . . . . 74.44 111.169 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 71.53 111.071 179.813 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.526 0.049 0 CA-C-O 119.239 -0.41 . . . . 74.14 110.882 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -93.86 163.18 13.61 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.521 1.138 . . . . 71.12 108.318 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.97 -53.01 22.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.031 -0.986 . . . . 73.21 110.886 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.36 -36.81 22.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 75.34 110.891 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 178' ' ' HIS . . . . . 0.505 ' NE2' HD22 ' A' ' 197' ' ' LEU . 48.3 m80 -89.29 88.34 7.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.133 -0.485 . . . . 74.32 110.882 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.31 -23.99 46.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 74.45 110.918 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -95.4 34.57 1.43 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.097 -0.501 . . . . 74.24 110.888 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -152.3 172.83 15.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 52.25 110.884 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.11 139.11 53.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.097 -0.502 . . . . 63.41 110.834 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 183' ' ' VAL . . . . . 0.843 HG11 HD22 ' A' ' 193' ' ' LEU . 8.1 m -50.9 169.3 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 71.33 111.15 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -130.39 -43.09 1.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 74.0 110.857 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -154.46 -172.81 4.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 74.33 110.853 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -124.07 127.76 48.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.28 -0.418 . . . . 75.23 110.905 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -82.07 107.21 14.59 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.513 1.133 . . . . 52.31 108.3 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 40.2 t -73.71 -26.76 22.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 114.994 -1.003 . . . . 72.43 111.125 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 189' ' ' THR . . . . . 0.516 HG23 ' HB2' ' A' ' 208' ' ' GLN . 0.0 OUTLIER -62.1 -56.16 21.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.226 -0.443 . . . . 73.34 111.131 -179.875 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.32 -12.39 37.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 71.55 110.869 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 1.9 t70 64.27 58.61 1.1 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 65.35 110.874 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -159.22 118.35 2.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 72.05 110.85 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 193' ' ' LEU . . . . . 0.843 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -50.74 148.83 3.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 45.32 110.856 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -147.41 -179.87 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.452 . . . . 73.04 111.144 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 23.3 p -123.46 -175.68 3.26 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.445 1.091 . . . . 45.4 108.339 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -71.82 -34.3 69.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.992 -1.004 . . . . 64.52 111.104 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.505 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.2 OUTLIER -69.5 -20.5 63.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 62.31 110.928 179.989 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 8.1 m -80.87 -35.99 31.91 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.477 1.11 . . . . 61.14 108.312 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 33.4 mtmt -77.17 -14.35 59.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.004 -0.998 . . . . 64.03 110.921 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.1 tp -105.14 -44.61 4.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.239 -0.437 . . . . 74.04 110.962 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 201' ' ' VAL . . . . . 0.446 HG21 ' CD2' ' A' ' 197' ' ' LEU . 44.1 t -89.68 -42.86 14.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.187 -0.46 . . . . 74.04 111.096 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.79 -140.67 0.91 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.72 -0.752 . . . . 74.54 112.47 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 80.0 mtm180 -132.51 22.78 4.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.853 0.359 . . . . 75.2 110.896 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -96.95 38.64 1.22 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.179 -0.464 . . . . 73.23 110.832 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 4.3 ttt85 -94.25 -43.95 8.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 65.13 110.839 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -93.71 7.13 45.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 73.35 110.812 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.8 m170 -79.78 174.84 11.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 73.15 110.852 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 208' ' ' GLN . . . . . 0.516 ' HB2' HG23 ' A' ' 189' ' ' THR . 0.5 OUTLIER -93.41 143.79 25.95 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.193 -0.458 . . . . 74.52 110.881 -179.926 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 29.9 m -150.32 -175.03 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 45.32 111.167 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.211 -0.45 . . . . 55.32 111.073 179.833 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 174' ' ' MET . . . . . 0.437 ' HA ' HG13 ' A' ' 183' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.526 0.029 0 CA-C-O 119.311 -0.376 . . . . 63.41 110.826 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -55.02 163.28 1.07 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.544 1.153 . . . . 74.12 108.34 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.82 -54.69 10.65 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.048 -0.978 . . . . 73.42 110.917 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -84.22 -36.88 22.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 63.14 110.941 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 10.0 m170 -88.93 64.2 7.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 62.32 110.833 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -24.52 52.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 52.14 110.896 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -95.54 34.71 1.43 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 65.34 110.775 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.499 ' CD ' HD13 ' A' ' 197' ' ' LEU . 0.3 OUTLIER -154.71 103.48 2.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 74.41 110.96 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.5 151.98 9.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 71.24 110.94 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 183' ' ' VAL . . . . . 0.722 HG11 HD22 ' A' ' 193' ' ' LEU . 27.6 m -69.67 172.15 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.457 . . . . 63.24 111.073 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -129.46 -45.55 1.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 71.01 110.892 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.11 -170.1 3.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 72.2 110.895 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -123.59 129.25 50.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 74.24 110.902 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -85.78 106.4 17.0 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.548 1.155 . . . . 63.43 108.264 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 99.7 t -75.01 -39.89 44.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 114.948 -1.024 . . . . 70.4 111.127 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 1.2 t -51.34 -39.18 56.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 63.01 111.107 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -106.75 -9.5 16.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.296 -0.411 . . . . 63.2 110.841 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 5.7 t70 61.43 55.2 2.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 75.54 110.868 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.65 127.5 6.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 75.24 110.876 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 193' ' ' LEU . . . . . 0.722 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -50.89 152.36 2.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.214 -0.448 . . . . 74.4 110.906 179.963 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -146.29 143.25 21.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.193 -0.458 . . . . 73.3 111.124 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 14.8 p -101.09 -175.4 2.86 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.554 1.159 . . . . 72.21 108.343 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -71.3 -41.28 70.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.062 -0.972 . . . . 72.11 111.11 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.499 HD13 ' CD ' ' A' ' 181' ' ' GLU . 0.4 OUTLIER -58.23 -25.35 61.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.288 -0.414 . . . . 73.04 110.919 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 62.9 m -81.22 -33.83 32.6 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.449 1.093 . . . . 64.24 108.301 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.38 -16.07 59.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.045 -0.979 . . . . 72.3 110.941 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.7 tp -105.68 -45.67 4.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 60.44 110.897 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 42.1 t -89.66 -43.21 14.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 73.51 111.192 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -72.86 -149.3 1.04 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.745 -0.74 . . . . 64.05 112.509 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.21 22.5 4.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.818 0.342 . . . . 63.2 110.843 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -90.04 47.94 1.51 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 64.3 110.901 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -94.07 -49.41 5.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.91 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -82.12 0.48 40.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.466 . . . . 75.24 110.864 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 38.6 m170 -79.85 120.9 24.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.252 -0.431 . . . . 72.22 110.821 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.53 153.9 18.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 73.05 110.931 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.5 m -147.7 -172.99 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 73.43 111.136 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 52.45 111.103 179.95 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.527 0.073 0 CA-C-O 119.285 -0.388 . . . . 75.31 110.811 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -77.01 162.0 27.89 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.566 1.166 . . . . 53.05 108.272 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.7 mp -71.62 -50.65 28.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.964 -1.017 . . . . 74.54 110.97 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -84.14 -38.74 20.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.183 -0.462 . . . . 72.41 110.894 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 178' ' ' HIS . . . . . 0.627 ' NE2' HD22 ' A' ' 197' ' ' LEU . 40.6 m80 -88.49 110.85 21.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 73.21 110.9 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -90.4 -32.99 16.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 61.1 110.915 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -95.23 34.78 1.37 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.074 -0.512 . . . . 74.1 110.862 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.608 ' HG3' HD12 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -154.32 106.54 2.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 75.12 110.881 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 8.2 mtpp -72.48 149.4 44.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.505 . . . . 70.24 110.882 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 183' ' ' VAL . . . . . 0.858 HG11 HD22 ' A' ' 193' ' ' LEU . 12.6 m -51.24 169.51 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.243 -0.435 . . . . 42.41 111.135 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -127.74 -38.76 1.85 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 72.31 110.909 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.3 -170.04 1.97 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 62.14 110.836 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -118.46 127.98 54.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 74.44 110.881 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -82.13 108.47 15.63 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.561 1.163 . . . . 72.21 108.248 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 61.6 t -73.81 -27.39 22.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 114.994 -1.003 . . . . 65.3 111.142 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.32 -55.78 24.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 52.44 111.113 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.58 -11.27 40.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.436 . . . . 63.13 110.842 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 18.4 t0 63.63 54.15 1.92 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 61.51 110.803 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -157.73 126.07 5.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.246 -0.434 . . . . 54.1 110.881 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 193' ' ' LEU . . . . . 0.858 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.13 150.91 4.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 70.44 110.924 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.7 pp -149.88 -179.4 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 74.43 111.107 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 17.5 p -126.78 -175.63 3.46 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.431 1.082 . . . . 64.43 108.294 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -73.12 -38.24 66.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.064 -0.971 . . . . 63.33 111.145 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.627 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.3 OUTLIER -59.03 -27.43 65.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 72.22 110.969 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 67.6 m -81.01 -34.07 33.18 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.514 1.134 . . . . 71.01 108.3 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -76.22 -15.42 60.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.977 -1.01 . . . . 75.4 110.911 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.73 -45.54 4.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 71.1 110.92 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 201' ' ' VAL . . . . . 0.566 ' CG2' HD23 ' A' ' 197' ' ' LEU . 53.5 t -89.64 -43.0 14.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.158 -0.474 . . . . 42.33 111.143 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.58 -146.55 0.93 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.667 -0.778 . . . . 64.44 112.469 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 53.2 ttt180 -128.12 24.68 5.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.771 0.32 . . . . 75.23 110.884 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 62.2 m-70 -94.12 39.91 1.08 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 74.21 110.856 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 7.7 ttm-85 -87.34 -45.66 10.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 74.42 110.856 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -89.57 5.53 45.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.178 -0.465 . . . . 72.42 110.854 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 41.5 m170 -81.04 120.17 24.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.218 -0.446 . . . . 64.3 110.882 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.94 143.89 50.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 72.34 110.875 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 19.0 m -140.37 -173.58 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 73.04 111.098 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 73.5 111.117 179.884 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 119.227 -0.416 . . . . 75.31 110.923 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -75.98 161.19 29.12 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.505 1.128 . . . . 51.52 108.307 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 10.6 mp -70.63 -51.74 25.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.027 -0.988 . . . . 70.32 110.989 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -84.03 -35.23 23.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.458 . . . . 64.33 110.899 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 22.6 m80 -94.64 93.74 7.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.106 -0.497 . . . . 70.13 110.859 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.03 -23.81 38.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.459 . . . . 74.01 110.857 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -95.44 34.62 1.43 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 75.04 110.872 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.75 112.98 1.94 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 50.02 110.894 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 14.4 pttt -72.11 146.08 47.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 71.05 110.882 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 183' ' ' VAL . . . . . 0.813 HG11 HD22 ' A' ' 193' ' ' LEU . 31.6 m -51.94 171.25 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.197 -0.456 . . . . 63.52 111.147 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -132.33 -38.72 1.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.169 -0.469 . . . . 63.22 110.89 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -158.61 -170.1 2.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 55.25 110.884 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -129.0 128.11 43.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 74.3 110.878 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -83.64 109.78 17.73 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.431 1.082 . . . . 74.43 108.294 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 39.6 t -75.27 -42.19 43.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 114.961 -1.018 . . . . 75.43 111.068 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 189' ' ' THR . . . . . 0.403 HG23 ' N ' ' A' ' 190' ' ' ASP . 3.5 t -51.69 -44.14 63.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 74.33 111.113 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 190' ' ' ASP . . . . . 0.403 ' N ' HG23 ' A' ' 189' ' ' THR . 9.0 m-20 -97.5 -14.95 20.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 73.14 110.868 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.85 56.54 1.86 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 63.34 110.847 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -158.77 120.36 3.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.465 . . . . 75.44 110.927 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 193' ' ' LEU . . . . . 0.813 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.25 148.91 5.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 72.24 110.875 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -144.88 -179.77 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.19 -0.459 . . . . 61.44 111.072 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.1 p -126.82 -175.52 3.43 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.592 1.183 . . . . 75.24 108.34 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.87 -32.68 65.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.002 -0.999 . . . . 45.35 111.077 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.86 -21.09 62.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 71.14 110.955 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 6.8 m -81.17 -35.35 31.55 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.485 1.116 . . . . 64.12 108.333 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? -76.96 -14.69 59.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.987 -1.006 . . . . 71.24 110.945 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.2 tp -105.38 -44.82 4.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 73.32 110.878 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 44.1 t -89.71 -42.91 14.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 61.44 111.131 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.54 -142.45 1.02 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.78 -0.724 . . . . 60.51 112.467 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 5.2 mtt85 -132.38 23.27 4.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.879 0.371 . . . . 71.33 110.881 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -94.55 38.36 1.11 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.162 -0.472 . . . . 70.3 110.825 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -94.22 -42.46 8.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.246 -0.433 . . . . 65.34 110.809 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -94.85 7.19 46.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.222 -0.444 . . . . 50.2 110.874 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.3 m170 -79.84 176.13 10.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 63.42 110.857 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.91 143.94 26.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 74.13 110.889 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 32.8 m -150.24 -175.61 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 73.52 111.198 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 72.1 111.072 179.878 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.141 0 CA-C-O 119.227 -0.416 . . . . 71.23 110.937 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -81.36 160.96 23.98 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.481 1.113 . . . . 74.45 108.269 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.0 mp -76.43 -45.96 29.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.927 -1.033 . . . . 63.5 110.944 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -84.4 -34.79 23.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 73.31 110.854 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 178' ' ' HIS . . . . . 0.747 ' CD2' HD22 ' A' ' 197' ' ' LEU . 37.8 m80 -99.44 78.49 2.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.137 -0.483 . . . . 75.22 110.878 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -62.74 -31.1 71.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.235 -0.438 . . . . 75.31 110.919 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -94.31 34.72 1.25 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.171 -0.468 . . . . 63.44 110.806 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.69 112.83 3.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.279 -0.418 . . . . 63.2 110.916 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 18.3 mtpt -72.51 144.62 47.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.185 -0.461 . . . . 61.51 110.845 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 183' ' ' VAL . . . . . 0.796 HG11 HD22 ' A' ' 193' ' ' LEU . 29.3 m -51.51 170.56 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.19 -0.459 . . . . 74.44 111.18 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -131.85 -38.71 1.12 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.449 . . . . 63.04 110.912 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.69 -170.03 2.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.197 -0.456 . . . . 74.32 110.868 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -128.54 127.98 43.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 75.14 110.949 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -83.72 109.84 17.82 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.45 1.094 . . . . 70.51 108.265 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 22.0 t -75.23 -42.11 44.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 114.939 -1.028 . . . . 71.35 111.132 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 189' ' ' THR . . . . . 0.402 HG23 ' N ' ' A' ' 190' ' ' ASP . 3.5 t -51.69 -44.07 63.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 72.42 111.154 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 190' ' ' ASP . . . . . 0.402 ' N ' HG23 ' A' ' 189' ' ' THR . 9.4 m-20 -97.56 -15.03 20.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.157 -0.474 . . . . 62.44 110.843 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 62.85 56.54 1.86 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.189 -0.46 . . . . 72.22 110.913 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -159.04 120.25 3.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 74.31 110.917 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 193' ' ' LEU . . . . . 0.796 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.17 148.87 5.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 75.51 110.905 -179.961 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -145.37 -179.63 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 75.02 111.099 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 25.6 p -126.74 -175.55 3.44 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.544 1.153 . . . . 72.21 108.317 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.81 -33.03 65.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.97 -1.014 . . . . 75.32 111.131 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.747 HD22 ' CD2' ' A' ' 178' ' ' HIS . 0.1 OUTLIER -70.43 -20.98 62.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.45 . . . . 63.44 110.947 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 7.7 m -81.26 -35.44 31.16 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.52 1.138 . . . . 74.22 108.288 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 26.0 mtmt -77.02 -14.77 59.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.99 -1.004 . . . . 75.33 110.886 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.3 tp -105.18 -44.7 4.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.232 -0.44 . . . . 71.04 110.938 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 201' ' ' VAL . . . . . 0.636 HG21 HD23 ' A' ' 197' ' ' LEU . 44.3 t -89.71 -42.81 14.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 72.12 111.075 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.96 -141.64 1.06 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.733 -0.746 . . . . 44.1 112.455 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 58.2 mtp180 -132.65 23.62 4.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.806 0.336 . . . . 73.25 110.819 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -94.78 37.95 1.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.235 -0.439 . . . . 64.41 110.894 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -94.14 -42.06 9.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.25 -0.432 . . . . 75.24 110.865 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 13.4 p-10 -95.34 7.14 47.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 64.12 110.895 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -79.79 177.16 9.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 74.2 110.913 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -96.99 143.94 27.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 54.23 110.932 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 34.5 m -150.4 -175.99 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 63.43 111.128 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 71.34 111.083 179.993 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 119.319 -0.372 . . . . 74.21 110.833 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.39 160.93 25.21 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.445 1.091 . . . . 72.31 108.283 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 2.5 mp -66.3 -55.29 16.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.984 -1.007 . . . . 73.23 110.929 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -84.35 -33.73 23.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.249 -0.432 . . . . 64.1 110.895 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -94.6 75.01 3.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 74.1 110.832 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -25.42 67.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 51.14 110.895 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.55 34.6 1.45 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.107 -0.497 . . . . 73.24 110.86 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -130.47 -172.61 2.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 61.35 110.916 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.9 mttp -136.95 120.88 17.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.226 -0.443 . . . . 65.22 110.896 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 19.8 m -51.31 165.03 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 72.33 111.183 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -134.05 -50.87 0.83 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 64.13 110.844 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 185' ' ' MET . . . . . 0.425 ' O ' HD23 ' A' ' 193' ' ' LEU . 0.0 OUTLIER -154.88 -170.1 3.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.187 -0.46 . . . . 55.34 110.932 179.998 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -127.12 129.56 48.16 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.323 -0.398 . . . . 70.11 110.951 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.33 105.31 14.18 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.477 1.111 . . . . 73.42 108.24 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 58.8 t -73.27 -26.16 22.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 114.966 -1.015 . . . . 74.45 111.12 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.6 -55.79 20.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 63.31 111.198 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -89.76 -10.32 46.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 40.44 110.866 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 6.1 t70 64.15 58.25 1.17 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.177 -0.465 . . . . 63.0 110.862 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -160.22 127.13 4.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 52.51 110.893 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 193' ' ' LEU . . . . . 0.425 HD23 ' O ' ' A' ' 185' ' ' MET . 0.2 OUTLIER -51.35 152.64 2.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 40.24 110.962 179.985 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 194' ' ' ILE . . . . . 0.557 HD11 HG11 ' A' ' 209' ' ' VAL . 1.0 OUTLIER -144.84 142.77 22.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 73.33 111.087 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 14.8 p -107.12 -174.32 2.51 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.475 1.109 . . . . 72.23 108.31 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.37 -44.45 78.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.032 -0.985 . . . . 72.41 111.088 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -20.35 62.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.449 . . . . 75.04 110.914 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 24.8 m -80.82 -32.55 35.16 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.497 1.123 . . . . 75.24 108.325 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 4.5 mtpm? -77.34 -15.85 59.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.027 -0.988 . . . . 73.13 110.9 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.6 tp -105.38 -44.85 4.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.463 . . . . 61.03 110.912 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 61.5 t -89.82 -42.57 14.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.215 -0.448 . . . . 73.2 111.118 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -78.25 -148.79 3.89 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.739 -0.743 . . . . 15.33 112.478 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 8.3 ttm180 -134.25 24.75 3.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.799 0.333 . . . . 74.03 110.841 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 204' ' ' HIS . . . . . 0.506 ' CG ' HG21 ' A' ' 194' ' ' ILE . 92.5 m-70 -95.47 38.84 1.14 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 74.01 110.858 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 3.6 ttp85 -94.22 -48.0 6.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.244 -0.434 . . . . 70.34 110.842 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -90.39 7.36 39.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 64.01 110.867 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 31.5 m170 -79.94 175.01 11.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 74.54 110.896 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 52.0 mm-40 -95.03 147.55 23.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.29 -0.414 . . . . 70.43 110.952 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 209' ' ' VAL . . . . . 0.557 HG11 HD11 ' A' ' 194' ' ' ILE . 35.9 m -150.33 -176.06 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 53.14 111.128 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.46 . . . . 64.41 111.132 179.869 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.086 0 CA-C-O 119.242 -0.408 . . . . 75.11 110.944 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -54.9 161.26 1.66 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.494 1.121 . . . . 45.52 108.301 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.2 mp -68.63 -54.77 14.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.969 -1.014 . . . . 71.31 110.905 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -83.98 -35.43 23.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.167 -0.469 . . . . 72.32 110.926 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 16.3 m80 -93.41 62.52 3.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.122 -0.49 . . . . 72.34 110.854 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -57.82 -23.6 53.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 72.33 110.947 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.45 34.6 1.43 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.122 -0.49 . . . . 64.54 110.809 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -151.47 89.29 1.48 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 73.42 110.872 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.97 121.0 5.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.103 -0.499 . . . . 71.25 110.916 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 183' ' ' VAL . . . . . 0.838 HG11 HD22 ' A' ' 193' ' ' LEU . 16.7 m -51.74 163.79 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.445 . . . . 73.0 111.129 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -117.41 -36.77 3.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.15 110.849 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -162.58 -168.54 1.85 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 71.24 110.813 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.718 ' CZ ' HG22 ' A' ' 188' ' ' VAL . 0.2 OUTLIER -132.52 138.64 47.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 65.12 110.905 -179.929 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -74.59 116.43 15.27 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.539 1.149 . . . . 62.13 108.245 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 188' ' ' VAL . . . . . 0.718 HG22 ' CZ ' ' A' ' 186' ' ' TYR . 68.7 t -74.74 -38.47 44.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 114.972 -1.013 . . . . 63.21 111.083 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.98 -53.64 55.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 74.33 111.173 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -86.14 -10.36 54.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 71.22 110.859 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 34.2 t70 57.31 50.38 11.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 73.25 110.815 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -148.61 127.33 12.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 53.3 110.913 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 193' ' ' LEU . . . . . 0.838 HD22 HG11 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -51.17 150.78 3.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.224 -0.444 . . . . 74.55 110.878 -179.958 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 194' ' ' ILE . . . . . 0.439 HG23 ' O ' ' A' ' 193' ' ' LEU . 1.0 OUTLIER -155.67 142.82 11.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.197 -0.456 . . . . 65.24 111.127 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 25.5 p -97.79 -175.02 3.05 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.488 1.118 . . . . 40.21 108.279 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.2 -33.73 67.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.934 -1.03 . . . . 63.51 111.079 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.22 -24.75 65.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.261 -0.427 . . . . 73.1 110.904 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 34.5 m -80.95 -31.69 34.82 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.499 1.124 . . . . 74.21 108.291 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 41.4 mtpt -77.16 -16.59 59.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.981 -1.009 . . . . 71.34 110.971 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.3 tp -105.48 -45.22 4.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.193 -0.458 . . . . 72.43 110.929 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 61.9 t -89.87 -42.69 14.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.451 . . . . 72.41 111.117 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -72.35 -147.37 0.71 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.706 -0.759 . . . . 70.25 112.484 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.0 21.74 6.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.838 0.352 . . . . 74.44 110.886 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -95.97 39.69 1.14 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.111 -0.495 . . . . 74.02 110.93 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -94.18 -40.89 9.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.237 -0.438 . . . . 74.23 110.901 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.37 7.15 46.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 60.13 110.792 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.8 m170 -83.19 -175.26 5.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.262 -0.426 . . . . 72.11 110.877 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -117.01 147.22 42.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 75.21 110.883 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 17.9 m -139.71 -173.21 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.452 . . . . 74.44 111.15 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 72.25 111.098 179.895 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.526 0.028 0 CA-C-O 119.307 -0.377 . . . . 62.13 110.829 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.3 164.17 1.01 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.521 1.138 . . . . 73.41 108.33 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.4 mp -77.02 -48.03 19.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.98 -1.009 . . . . 64.11 110.918 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -84.17 -43.27 15.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 72.21 110.858 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 178' ' ' HIS . . . . . 0.484 ' CD2' HD13 ' A' ' 197' ' ' LEU . 20.7 m80 -89.77 62.11 5.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 75.21 110.869 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -52.24 -29.77 24.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.177 -0.465 . . . . 42.01 110.912 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -93.91 35.01 1.17 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 62.32 110.913 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.697 ' HG3' HD12 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -151.77 96.57 2.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 73.12 110.872 -179.851 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.48 126.38 27.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 73.1 110.902 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 183' ' ' VAL . . . . . 0.842 HG11 HD22 ' A' ' 193' ' ' LEU . 16.8 m -51.77 163.34 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.434 . . . . 74.43 111.102 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -118.96 -37.41 3.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 71.11 110.878 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.21 -168.45 2.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 73.15 110.831 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.748 ' CZ ' HG22 ' A' ' 188' ' ' VAL . 0.4 OUTLIER -132.71 138.69 47.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 72.21 110.947 -179.874 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.65 113.75 10.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.575 1.172 . . . . 64.2 108.359 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 188' ' ' VAL . . . . . 0.748 HG22 ' CZ ' ' A' ' 186' ' ' TYR . 60.5 t -74.21 -28.67 23.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.003 -0.998 . . . . 72.53 111.107 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.73 -56.34 16.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.453 . . . . 43.45 111.141 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.36 -4.59 55.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.246 -0.434 . . . . 72.41 110.843 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 6.2 t70 57.05 50.64 11.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 73.03 110.862 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.52 127.41 17.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 72.24 110.929 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 193' ' ' LEU . . . . . 0.842 HD22 HG11 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -51.64 150.67 3.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.162 -0.472 . . . . 72.21 110.919 -179.981 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 194' ' ' ILE . . . . . 0.462 HG23 ' O ' ' A' ' 193' ' ' LEU . 1.0 OUTLIER -156.45 142.57 10.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 70.44 111.163 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 20.8 p -97.47 -175.1 3.1 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.434 1.084 . . . . 71.5 108.31 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.02 -35.9 69.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.971 -1.013 . . . . 60.4 111.081 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.697 HD12 ' HG3' ' A' ' 181' ' ' GLU . 0.2 OUTLIER -64.98 -24.71 67.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 61.12 110.883 -179.983 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 37.0 m -81.08 -32.39 33.97 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.422 1.076 . . . . 52.23 108.27 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 30.9 mtmt -76.45 -16.53 59.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.99 -1.005 . . . . 73.42 110.842 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.3 tp -105.74 -45.51 4.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 61.13 110.939 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 201' ' ' VAL . . . . . 0.627 ' CG2' HD23 ' A' ' 197' ' ' LEU . 53.0 t -89.73 -42.93 14.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.16 -0.473 . . . . 74.41 111.197 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -71.79 -149.2 0.76 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.743 -0.742 . . . . 53.45 112.462 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.52 20.7 6.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.808 0.337 . . . . 74.24 110.874 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -96.71 39.38 1.17 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 74.33 110.907 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.08 -47.94 6.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 41.24 110.882 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.76 2.03 39.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.223 -0.444 . . . . 75.32 110.891 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 36.3 m170 -79.98 -176.46 5.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 73.42 110.876 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.09 144.61 42.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.196 -0.456 . . . . 64.02 110.884 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.9 m -135.57 -175.23 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.205 -0.452 . . . . 72.44 111.124 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.097 -0.501 . . . . 75.02 111.038 179.898 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.085 0 CA-C-O 119.278 -0.392 . . . . 51.21 110.862 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -61.75 162.01 9.3 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.496 1.122 . . . . 60.33 108.271 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 3.9 mp -68.25 -53.1 26.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.98 -1.009 . . . . 72.33 110.94 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -84.27 -35.39 23.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 61.23 110.879 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 178' ' ' HIS . . . . . 0.522 ' NE2' HD22 ' A' ' 197' ' ' LEU . 32.4 m80 -91.98 71.03 5.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 70.13 110.884 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -24.36 67.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.203 -0.453 . . . . 71.05 110.914 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -95.44 34.73 1.41 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.481 . . . . 74.55 110.77 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.521 ' OE1' HD13 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -140.1 -169.3 2.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 74.35 110.892 -179.978 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 9.7 tttt -140.71 127.61 20.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.485 . . . . 72.25 110.855 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 183' ' ' VAL . . . . . 0.787 HG11 HD22 ' A' ' 193' ' ' LEU . 3.3 m -50.61 167.81 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 70.0 111.081 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 39.6 t-20 -127.82 -38.08 1.89 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 73.43 110.856 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 1.2 mmt -164.17 -171.63 2.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 71.32 110.863 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.401 ' O ' HG12 ' A' ' 209' ' ' VAL . 51.3 t80 -117.07 126.93 53.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.216 -0.447 . . . . 71.21 110.954 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -83.43 107.06 15.68 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.45 1.094 . . . . 73.24 108.281 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 60.4 t -75.49 -41.27 42.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.011 -0.995 . . . . 64.13 111.1 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 189' ' ' THR . . . . . 0.544 HG23 ' OD2' ' A' ' 190' ' ' ASP . 1.2 t -50.49 -34.76 26.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.476 . . . . 71.34 111.079 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 190' ' ' ASP . . . . . 0.544 ' OD2' HG23 ' A' ' 189' ' ' THR . 1.1 m-20 -111.73 -9.44 14.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.266 -0.424 . . . . 54.52 110.827 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 9.2 t0 60.23 55.18 3.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 72.23 110.935 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -158.37 125.99 5.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.126 -0.488 . . . . 73.43 110.942 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 193' ' ' LEU . . . . . 0.787 HD22 HG11 ' A' ' 183' ' ' VAL . 0.1 OUTLIER -57.1 149.18 19.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.457 . . . . 72.35 110.904 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -150.32 -179.28 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 63.53 111.119 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 27.6 p -123.51 -175.51 3.22 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.509 1.131 . . . . 64.11 108.225 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -73.29 -32.28 64.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.983 -1.008 . . . . 61.11 111.06 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.522 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.3 OUTLIER -65.64 -25.5 67.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 74.32 110.951 -179.991 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 57.8 m -81.03 -35.45 31.86 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 124.568 1.168 . . . . 72.32 108.311 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 4.0 mtmt -76.91 -14.76 59.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.976 -1.011 . . . . 70.44 110.869 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.8 tp -105.38 -45.0 4.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.266 -0.425 . . . . 74.13 110.903 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 43.6 t -89.64 -43.0 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 62.21 111.122 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.94 -142.28 0.67 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.715 -0.755 . . . . 70.43 112.478 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -128.26 23.17 6.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.766 0.317 . . . . 72.44 110.896 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 -97.86 39.56 1.21 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.162 -0.472 . . . . 75.41 110.898 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -84.48 -40.51 17.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 71.2 110.859 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -97.95 7.05 46.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 65.3 110.905 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 207' ' ' HIS . . . . . 0.431 ' CG ' HG21 ' A' ' 189' ' ' THR . 39.3 m170 -80.5 120.48 24.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 74.14 110.813 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -59.64 163.66 4.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 73.03 110.913 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 209' ' ' VAL . . . . . 0.401 HG12 ' O ' ' A' ' 186' ' ' TYR . 14.0 m -149.11 -176.32 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 73.01 111.137 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.2 -0.455 . . . . 65.1 111.138 179.798 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 119.221 -0.418 . . . . 74.13 110.888 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.32 161.59 16.28 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.499 1.124 . . . . 73.0 108.31 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.76 -53.26 34.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.008 -0.996 . . . . 75.31 110.946 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -84.62 -36.35 22.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 71.45 110.869 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 34.0 m80 -91.47 88.94 7.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 64.32 110.776 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -78.5 -25.46 45.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 63.43 110.86 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -95.5 34.58 1.44 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 74.5 110.896 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -141.3 179.57 6.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 75.32 110.908 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.14 128.34 41.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 73.34 110.88 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 183' ' ' VAL . . . . . 0.794 HG11 HD22 ' A' ' 193' ' ' LEU . 22.8 m -50.81 168.0 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.157 -0.474 . . . . 63.12 111.165 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -127.6 -38.49 1.9 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.258 -0.428 . . . . 63.42 110.893 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -164.52 -170.15 1.96 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 62.34 110.831 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -120.11 127.4 52.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 72.15 110.956 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -80.67 108.05 13.99 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.446 1.091 . . . . 53.34 108.268 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 53.1 t -73.8 -28.49 24.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 114.955 -1.02 . . . . 63.34 111.191 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -55.6 28.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.133 -0.485 . . . . 73.11 111.191 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.5 -11.31 40.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 52.51 110.84 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 4.8 t70 63.51 55.05 1.82 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 75.43 110.889 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -157.39 125.12 5.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 72.52 110.88 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 193' ' ' LEU . . . . . 0.794 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.86 148.87 6.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.24 -0.436 . . . . 65.35 110.864 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.2 pp -147.24 -179.88 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 51.5 111.133 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 22.1 p -126.97 -175.67 3.49 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.465 1.103 . . . . 61.54 108.291 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -71.89 -34.68 69.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.992 -1.004 . . . . 53.54 111.123 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -23.69 67.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 64.12 110.942 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 51.7 m -80.97 -36.08 31.3 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.54 1.15 . . . . 73.41 108.317 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.74 -14.7 59.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.939 -1.028 . . . . 65.44 110.929 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.4 tp -105.19 -44.99 4.62 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.213 -0.448 . . . . 53.45 110.89 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 42.1 t -89.54 -43.08 14.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 71.42 111.104 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.71 -142.41 1.07 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.753 -0.737 . . . . 70.02 112.517 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 3.3 mtp85 -132.98 24.77 4.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.831 0.348 . . . . 74.55 110.827 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 50.1 m-70 -93.8 40.73 1.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 74.03 110.832 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 9.3 ptt85 -89.07 -39.74 13.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.277 -0.42 . . . . 71.25 110.875 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -94.8 3.8 54.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.199 -0.455 . . . . 73.1 110.851 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 48.5 m170 -79.95 120.18 23.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 74.3 110.855 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.84 143.89 50.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 62.22 110.891 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.7 m -139.69 -173.4 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.475 . . . . 55.41 111.089 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.231 -0.44 . . . . 30.42 111.097 179.907 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.085 0 CA-C-O 119.292 -0.385 . . . . 65.42 110.861 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -95.05 160.98 14.32 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 75.01 108.267 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.25 -55.63 20.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.961 -1.018 . . . . 62.54 110.883 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -84.56 -33.63 23.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.429 . . . . 73.21 110.859 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 178' ' ' HIS . . . . . 0.615 ' NE2' HD22 ' A' ' 197' ' ' LEU . 28.2 m80 -94.96 65.85 2.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.476 . . . . 74.31 110.872 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.64 -28.48 67.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.435 . . . . 64.4 110.9 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -93.23 35.1 1.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 52.21 110.843 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.402 ' OE2' HD12 ' A' ' 197' ' ' LEU . 0.4 OUTLIER -135.54 175.31 9.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 72.41 110.883 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.63 113.55 13.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 72.51 110.92 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 183' ' ' VAL . . . . . 0.789 HG11 HD22 ' A' ' 193' ' ' LEU . 16.0 m -51.43 160.94 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.424 . . . . 61.5 111.151 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -122.87 -39.21 2.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 74.42 110.826 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 185' ' ' MET . . . . . 0.405 ' O ' HD23 ' A' ' 193' ' ' LEU . 0.0 OUTLIER -156.26 -169.4 3.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.471 . . . . 53.54 110.845 179.971 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.623 ' CE1' HG22 ' A' ' 188' ' ' VAL . 0.3 OUTLIER -133.31 138.84 46.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.224 -0.444 . . . . 71.24 110.894 -179.864 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.66 114.79 12.31 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.495 1.122 . . . . 75.45 108.274 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 188' ' ' VAL . . . . . 0.623 HG22 ' CE1' ' A' ' 186' ' ' TYR . 20.7 t -74.29 -30.53 26.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 114.992 -1.004 . . . . 73.43 111.145 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.58 -56.08 21.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 73.55 111.18 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.59 -5.2 56.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.265 -0.425 . . . . 74.21 110.921 179.853 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 23.8 t70 56.59 50.08 13.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 70.13 110.893 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -143.81 127.32 16.94 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.143 -0.48 . . . . 74.23 110.916 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 193' ' ' LEU . . . . . 0.789 HD22 HG11 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -51.33 151.02 3.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 73.44 110.944 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 194' ' ' ILE . . . . . 0.46 HG23 ' O ' ' A' ' 193' ' ' LEU . 1.0 OUTLIER -156.32 142.84 10.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 72.51 111.148 179.865 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.2 p -97.75 -175.19 3.1 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.524 1.14 . . . . 71.34 108.322 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.29 -32.69 66.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.0 -1.0 . . . . 33.11 111.118 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.615 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.2 OUTLIER -70.31 -22.2 62.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.26 -0.427 . . . . 71.34 110.858 -179.992 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 12.8 m -80.89 -33.6 34.16 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.446 1.091 . . . . 52.4 108.363 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -76.91 -15.6 59.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.977 -1.011 . . . . 74.12 110.9 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.9 tp -105.58 -45.15 4.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 73.24 110.879 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 201' ' ' VAL . . . . . 0.406 HG21 ' CD2' ' A' ' 197' ' ' LEU . 48.2 t -89.66 -42.8 14.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 53.55 111.207 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.48 -145.0 0.75 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.708 -0.758 . . . . 61.42 112.474 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -129.58 21.55 5.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.79 0.328 . . . . 74.33 110.907 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -99.28 39.86 1.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.244 -0.435 . . . . 51.42 110.864 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -94.24 -48.19 6.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 73.35 110.854 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -84.54 2.87 39.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.243 -0.435 . . . . 60.24 110.899 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.0 m170 -80.22 -176.75 5.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.461 . . . . 73.12 110.854 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -112.92 151.81 30.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 73.02 110.901 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.9 m -143.01 -175.88 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.462 . . . . 72.53 111.122 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 70.13 111.064 179.901 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.088 0 CA-C-O 119.252 -0.404 . . . . 61.12 110.892 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.92 161.0 1.76 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.505 1.128 . . . . 73.4 108.332 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 10.5 mp -73.58 -47.92 36.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.048 -0.978 . . . . 70.12 110.906 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -84.21 -42.26 16.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.213 -0.448 . . . . 74.1 110.875 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 178' ' ' HIS . . . . . 0.72 ' CD2' HD22 ' A' ' 197' ' ' LEU . 24.0 m80 -91.89 62.11 4.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.078 -0.51 . . . . 72.34 110.828 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.44 -29.88 26.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 74.13 110.858 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -93.99 34.98 1.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.156 -0.475 . . . . 73.04 110.942 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.8 96.68 2.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.149 -0.478 . . . . 74.5 110.848 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -56.76 132.67 52.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 74.4 110.899 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 183' ' ' VAL . . . . . 0.854 HG11 HD22 ' A' ' 193' ' ' LEU . 20.0 m -61.3 165.73 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 71.14 111.149 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -119.65 -35.54 3.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 74.24 110.864 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -162.43 -168.27 1.8 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 70.02 110.934 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.748 ' CZ ' HG22 ' A' ' 188' ' ' VAL . 0.3 OUTLIER -132.6 138.51 47.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.289 -0.414 . . . . 62.31 110.931 -179.855 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.8 114.08 10.55 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.506 1.129 . . . . 51.02 108.278 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 188' ' ' VAL . . . . . 0.748 HG22 ' CZ ' ' A' ' 186' ' ' TYR . 60.1 t -74.32 -29.55 24.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 114.972 -1.013 . . . . 71.51 111.083 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -56.23 18.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 75.23 111.171 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -90.79 -5.1 56.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 61.35 110.895 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 3.7 t0 56.99 50.62 11.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 74.45 110.851 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -144.06 127.34 16.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 43.03 110.899 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 193' ' ' LEU . . . . . 0.854 HD22 HG11 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -51.58 150.27 3.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.243 -0.435 . . . . 71.35 110.882 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 194' ' ' ILE . . . . . 0.454 HG23 ' O ' ' A' ' 193' ' ' LEU . 1.0 OUTLIER -156.27 142.6 10.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.194 -0.457 . . . . 74.42 111.157 179.849 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.5 p -95.8 -175.21 3.36 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 74.44 108.279 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.31 -32.72 66.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.993 -1.003 . . . . 63.0 111.096 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.72 HD22 ' CD2' ' A' ' 178' ' ' HIS . 0.1 OUTLIER -69.02 -24.04 64.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 72.43 110.859 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 23.4 m -81.27 -31.32 33.73 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.514 1.134 . . . . 45.44 108.336 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -76.46 -17.54 59.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.002 -0.999 . . . . 65.14 110.873 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.9 tp -105.99 -45.88 4.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 72.22 110.922 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 44.6 t -89.81 -43.3 14.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.203 -0.453 . . . . 34.24 111.106 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -67.72 -153.8 0.42 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 74.45 112.551 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -120.08 19.29 12.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.818 0.342 . . . . 54.51 110.852 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -96.26 47.49 1.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 70.11 110.861 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.11 -51.16 4.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.23 -0.441 . . . . 73.43 110.843 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.9 7.2 31.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.881 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 33.5 m170 -79.81 -176.41 5.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.47 . . . . 72.33 110.933 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -117.55 146.07 43.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 73.24 110.917 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.9 m -136.17 -174.51 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 64.55 111.157 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.454 . . . . 63.32 111.069 179.931 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 69.1 m . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.897 0.38 . . . . 71.43 110.843 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 23.3 t-80 -168.34 65.47 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 72.44 110.856 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 20.1 pt -104.58 37.64 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 74.3 111.149 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 27.6 mtp180 -141.67 148.2 38.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.155 -0.475 . . . . 74.23 110.851 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 152.59 161.5 10.29 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.726 -0.75 . . . . 73.35 112.497 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.415 ' O ' HG13 ' A' ' 183' ' ' VAL . 8.8 mt -119.09 56.96 0.89 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.873 0.368 . . . . 72.2 110.907 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -70.44 -173.57 0.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 64.54 110.873 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.2 161.09 29.66 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.438 1.086 . . . . 55.42 108.334 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 1.1 mp -74.1 -47.95 32.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.057 -0.974 . . . . 61.04 110.943 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.15 -36.02 23.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 75.15 110.902 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 178' ' ' HIS . . . . . 0.664 ' NE2' HD22 ' A' ' 197' ' ' LEU . 49.4 m80 -93.97 104.5 16.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.132 -0.485 . . . . 63.33 110.888 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.62 -32.83 25.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 65.23 110.869 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -94.95 34.71 1.33 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 62.01 110.845 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.635 ' OE2' HD12 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -155.71 113.08 3.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 63.42 110.885 -179.898 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.17 153.28 36.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 74.04 110.943 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 183' ' ' VAL . . . . . 0.834 HG11 HD22 ' A' ' 193' ' ' LEU . 12.7 m -53.59 174.52 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 61.14 111.14 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 55.5 t-20 -132.83 -40.86 0.94 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 73.4 110.928 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.1 -170.12 2.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 72.14 110.9 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.58 ' CE2' HG22 ' A' ' 188' ' ' VAL . 10.9 t80 -119.61 123.75 44.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 75.25 110.939 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.44 108.49 14.11 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.489 1.118 . . . . 55.33 108.35 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 188' ' ' VAL . . . . . 0.58 HG22 ' CE2' ' A' ' 186' ' ' TYR . 65.7 t -73.81 -26.79 21.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.013 -0.994 . . . . 71.12 111.123 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 189' ' ' THR . . . . . 0.725 HG23 ' HB2' ' A' ' 208' ' ' GLN . 0.8 OUTLIER -61.63 -56.73 16.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.193 -0.458 . . . . 75.33 111.181 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -89.91 -12.45 38.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.197 -0.456 . . . . 55.21 110.866 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 5.5 t0 64.33 58.67 1.08 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.209 -0.451 . . . . 52.3 110.944 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -162.52 124.39 2.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 73.51 110.92 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.834 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.81 149.33 6.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.174 -0.466 . . . . 73.31 110.896 -179.981 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -147.87 -178.87 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 55.23 111.192 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 20.4 p -125.7 -175.29 3.3 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.549 1.156 . . . . 44.13 108.308 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -73.15 -35.84 66.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.013 -0.994 . . . . 72.21 111.064 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.664 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.2 OUTLIER -64.67 -24.16 67.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.192 -0.458 . . . . 72.31 110.894 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 30.1 m -81.17 -34.87 32.09 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.558 1.161 . . . . 73.25 108.353 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 28.3 mtmt -76.89 -14.86 59.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.036 -0.983 . . . . 74.33 110.957 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 5.7 tp -105.35 -44.86 4.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 72.13 110.922 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 201' ' ' VAL . . . . . 0.578 HG21 HD23 ' A' ' 197' ' ' LEU . 47.2 t -89.73 -42.8 14.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.2 -0.455 . . . . 72.33 111.12 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -74.89 -142.33 0.84 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.79 -0.719 . . . . 54.41 112.48 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -129.08 23.95 5.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.855 0.359 . . . . 74.51 110.859 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -95.65 37.35 1.21 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 51.41 110.876 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 10.5 ptt-85 -94.31 -32.7 13.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 74.24 110.872 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -105.03 7.23 33.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 71.15 110.844 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 51.0 m170 -79.68 174.92 11.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 65.14 110.885 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 208' ' ' GLN . . . . . 0.725 ' HB2' HG23 ' A' ' 189' ' ' THR . 0.5 OUTLIER -99.23 144.46 28.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 63.02 110.961 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 34.0 m -146.21 -175.88 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.25 -0.432 . . . . 63.43 111.14 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -137.56 110.15 7.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 73.13 111.127 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -94.54 138.22 32.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.281 -0.418 . . . . 71.3 111.135 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 63.37 105.29 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 74.44 110.829 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 3.9 m -56.61 115.13 2.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 72.15 110.841 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.146 -0.479 . . . . 70.25 110.93 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 45.9 m . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.88 0.372 . . . . 72.15 110.847 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 25.2 m-70 -117.03 33.35 5.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.113 -0.494 . . . . 73.3 110.865 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 170' ' ' ILE . . . . . 0.437 HG23 ' H ' ' A' ' 172' ' ' GLY . 15.4 tt -77.42 -28.54 16.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 65.41 111.116 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 57.87 39.46 26.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 74.1 110.846 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 172' ' ' GLY . . . . . 0.437 ' H ' HG23 ' A' ' 170' ' ' ILE . . . -59.63 129.14 48.21 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.744 -0.741 . . . . 71.31 112.505 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.594 ' O ' HG22 ' A' ' 183' ' ' VAL . 1.3 mt -108.25 74.32 0.93 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.841 0.353 . . . . 53.22 110.911 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 174' ' ' MET . . . . . 0.44 ' HE1' ' HG2' ' A' ' 179' ' ' GLU . 0.0 OUTLIER -110.14 -169.82 1.54 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 71.25 110.857 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.04 161.13 20.82 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.477 1.111 . . . . 70.4 108.3 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.23 -53.47 29.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.003 -0.999 . . . . 71.42 110.882 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.4 -36.58 22.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.445 . . . . 72.12 110.863 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -91.08 90.39 7.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 74.11 110.803 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 179' ' ' GLU . . . . . 0.44 ' HG2' ' HE1' ' A' ' 174' ' ' MET . 1.2 mt-10 -86.27 4.85 37.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 74.21 110.921 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -120.03 34.69 5.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.118 -0.492 . . . . 73.4 110.859 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.88 -169.93 3.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 75.33 110.868 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.55 125.72 26.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 75.01 110.934 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 183' ' ' VAL . . . . . 0.594 HG22 ' O ' ' A' ' 173' ' ' LEU . 31.2 m -51.48 167.64 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 53.32 111.137 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -133.05 -51.19 0.89 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 74.12 110.864 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -148.87 -172.18 4.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 73.32 110.86 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -127.48 130.67 49.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.184 -0.462 . . . . 75.5 110.937 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.64 104.75 14.0 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.447 1.092 . . . . 63.44 108.313 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 43.1 t -73.26 -27.24 23.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 114.979 -1.009 . . . . 55.15 111.132 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.31 -55.41 24.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 71.32 111.145 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.05 -10.87 45.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 75.43 110.872 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 2.4 t70 64.45 59.25 1.0 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 55.43 110.887 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -161.86 127.08 3.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 62.32 110.917 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.476 HD22 ' CG1' ' A' ' 183' ' ' VAL . 0.2 OUTLIER -51.72 152.26 2.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 74.33 110.922 -179.986 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 194' ' ' ILE . . . . . 0.609 HD11 HG11 ' A' ' 209' ' ' VAL . 1.0 OUTLIER -144.64 142.86 23.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.444 . . . . 55.13 111.157 179.815 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 19.6 p -104.41 -175.09 2.7 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.507 1.129 . . . . 64.23 108.331 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -68.73 -39.03 80.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.024 -0.989 . . . . 72.12 111.078 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.16 -18.45 64.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 65.44 110.924 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 5.7 m -80.97 -33.48 33.82 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.524 1.14 . . . . 61.23 108.306 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.33 -15.52 59.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.978 -1.01 . . . . 64.23 110.925 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 tp -105.3 -44.75 4.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 75.04 110.887 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 49.0 t -89.85 -42.49 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 71.34 111.14 179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -77.87 -146.59 2.79 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.762 -0.733 . . . . 55.31 112.471 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -134.24 24.25 3.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.852 0.358 . . . . 75.1 110.837 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 204' ' ' HIS . . . . . 0.518 ' CG ' HG21 ' A' ' 194' ' ' ILE . 89.6 m-70 -95.99 38.68 1.17 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 71.12 110.842 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 10.3 ttm-85 -94.18 -47.69 6.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 64.02 110.878 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.49 7.14 40.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.199 -0.455 . . . . 75.14 110.83 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -79.94 174.94 11.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 74.52 110.847 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.64 143.97 25.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 75.03 110.916 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 209' ' ' VAL . . . . . 0.609 HG11 HD11 ' A' ' 194' ' ' ILE . 26.9 m -150.71 -176.22 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 74.54 111.133 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -139.34 -170.54 2.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 74.13 111.087 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -128.66 168.04 16.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 52.21 111.096 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -158.28 163.67 37.17 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.218 -0.447 . . . . 75.12 110.925 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 63.19 -172.02 0.17 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 62.22 110.861 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 44.23 110.865 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 70.0 m . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.926 0.393 . . . . 64.35 110.832 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 19.6 m-70 -55.87 130.01 41.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.122 -0.49 . . . . 74.43 110.823 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 11.8 tt -141.64 146.24 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 75.4 111.058 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -129.72 171.93 12.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 73.42 110.888 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 172' ' ' GLY . . . . . 0.474 ' O ' HD22 ' A' ' 173' ' ' LEU . . . -111.9 -166.99 17.96 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.727 -0.749 . . . . 42.51 112.467 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.474 HD22 ' O ' ' A' ' 172' ' ' GLY . 4.1 mm? -127.06 104.88 8.22 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.818 0.342 . . . . 75.24 110.93 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.3 -174.19 4.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 75.42 110.879 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -72.34 163.44 27.97 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.513 1.133 . . . . 74.32 108.285 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.63 -52.44 17.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.99 -1.005 . . . . 51.23 110.901 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -84.05 -37.15 22.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 73.52 110.941 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 178' ' ' HIS . . . . . 0.624 ' NE2' HD22 ' A' ' 197' ' ' LEU . 29.3 m80 -88.66 91.71 8.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 73.54 110.882 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -26.29 53.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.239 -0.437 . . . . 72.32 110.87 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -97.93 34.41 1.91 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.232 -0.44 . . . . 65.45 110.891 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.61 ' OE2' HD12 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -156.29 113.09 3.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 70.43 110.9 -179.849 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.3 149.83 40.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 65.44 110.933 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 183' ' ' VAL . . . . . 0.835 HG11 HD22 ' A' ' 193' ' ' LEU . 15.9 m -53.59 175.17 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.289 -0.414 . . . . 55.42 111.19 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -131.04 -40.05 1.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 72.11 110.847 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.15 -170.18 2.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 71.41 110.95 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.537 ' CE2' HG22 ' A' ' 188' ' ' VAL . 14.8 t80 -117.15 124.64 49.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.277 -0.419 . . . . 74.14 110.93 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -81.35 107.98 14.58 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.552 1.157 . . . . 73.13 108.258 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 188' ' ' VAL . . . . . 0.537 HG22 ' CE2' ' A' ' 186' ' ' TYR . 91.4 t -74.08 -28.67 23.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.024 -0.989 . . . . 73.43 111.085 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.86 -56.47 20.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 72.42 111.149 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.69 -12.36 39.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.242 -0.436 . . . . 63.24 110.916 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 6.2 t0 64.0 56.36 1.44 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 53.22 110.881 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -161.0 122.99 3.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.453 . . . . 74.14 110.931 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.835 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -50.7 148.64 3.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.138 -0.483 . . . . 64.11 110.943 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -147.33 -178.87 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.252 -0.431 . . . . 72.25 111.153 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 18.6 p -125.23 -175.44 3.31 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.49 1.119 . . . . 62.34 108.323 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -74.29 -36.12 63.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.057 -0.974 . . . . 70.4 111.069 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.624 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.3 OUTLIER -60.67 -27.42 67.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 64.15 111.006 180.0 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 67.0 m -81.03 -35.11 32.29 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.447 1.092 . . . . 52.03 108.341 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -76.85 -14.96 59.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.998 -1.001 . . . . 74.43 110.911 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.5 tp -105.32 -44.93 4.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.182 -0.463 . . . . 34.12 110.926 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 45.0 t -89.67 -42.87 14.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 73.55 111.111 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.43 -142.93 1.04 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.742 -0.742 . . . . 72.34 112.453 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -129.7 24.79 5.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.84 0.352 . . . . 61.21 110.878 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -92.36 43.99 1.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 74.02 110.882 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.65 -47.08 7.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.45 . . . . 73.22 110.868 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -88.15 6.95 34.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 75.14 110.848 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 41.7 m170 -81.94 120.33 25.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 74.33 110.87 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.96 143.9 50.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.218 -0.446 . . . . 63.22 110.933 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.8 m -140.92 -173.57 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 72.42 111.16 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -124.81 109.1 12.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 72.33 111.122 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -83.81 124.47 30.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.283 -0.417 . . . . 70.01 111.064 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 4.6 tp -126.94 140.68 52.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.477 . . . . 72.03 110.884 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 4.1 t -154.68 121.19 5.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 74.31 110.863 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.106 -0.497 . . . . 55.32 110.876 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 17.5 p . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.908 0.385 . . . . 73.41 110.843 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 11.4 t60 -86.85 109.13 19.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 72.44 110.859 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 17.0 tt -148.89 142.84 18.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 74.21 111.185 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -126.61 144.34 50.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.193 -0.458 . . . . 71.55 110.842 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -105.46 121.99 7.03 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.742 -0.742 . . . . 75.11 112.524 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.562 ' O ' HG22 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -86.49 140.41 29.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.749 0.309 . . . . 71.53 110.956 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -110.0 175.5 5.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.277 -0.42 . . . . 61.31 110.93 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -59.87 165.19 3.32 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.505 1.128 . . . . 54.42 108.306 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.28 -52.82 12.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.003 -0.999 . . . . 75.14 110.824 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -84.12 -37.39 22.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 72.35 110.817 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 27.5 m80 -87.48 120.09 28.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 74.23 110.845 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -98.66 -31.65 11.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 64.22 110.892 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -95.88 34.59 1.5 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.486 . . . . 63.01 110.883 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.515 ' CD ' HD13 ' A' ' 197' ' ' LEU . 1.7 mp0 -153.48 90.3 1.4 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 73.02 110.935 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -57.33 147.32 26.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.446 . . . . 73.32 110.92 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 183' ' ' VAL . . . . . 0.752 HG11 HD22 ' A' ' 193' ' ' LEU . 21.8 m -51.86 171.11 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.273 -0.421 . . . . 63.3 111.172 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -132.45 -39.39 1.02 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.213 -0.449 . . . . 50.32 110.897 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.07 -169.95 1.99 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 72.32 110.88 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.679 ' CE2' HG22 ' A' ' 188' ' ' VAL . 9.0 t80 -123.32 124.88 43.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.261 -0.427 . . . . 64.32 110.921 -179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 187' ' ' CYS . . . . . 0.456 ' HA ' HG12 ' A' ' 209' ' ' VAL . 0.1 OUTLIER -83.99 110.22 18.26 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.482 1.114 . . . . 62.33 108.366 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 188' ' ' VAL . . . . . 0.679 HG22 ' CE2' ' A' ' 186' ' ' TYR . 62.0 t -75.3 -40.71 43.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 114.95 -1.023 . . . . 75.02 111.081 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 189' ' ' THR . . . . . 0.4 HG23 ' N ' ' A' ' 190' ' ' ASP . 3.4 t -51.68 -44.61 63.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 64.13 111.117 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 190' ' ' ASP . . . . . 0.4 ' N ' HG23 ' A' ' 189' ' ' THR . 11.7 m-20 -97.49 -16.28 20.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.45 . . . . 64.21 110.774 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 9.4 t0 63.88 58.08 1.27 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.245 -0.434 . . . . 72.33 110.869 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -163.5 121.19 1.87 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.22 -0.446 . . . . 71.41 110.943 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.752 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -50.86 148.77 3.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.256 -0.429 . . . . 74.3 110.861 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.1 pp -144.55 -179.49 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 65.34 111.132 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.9 p -128.02 -175.56 3.53 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.47 1.106 . . . . 74.32 108.368 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.57 -34.02 67.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.027 -0.988 . . . . 62.32 111.027 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.515 HD13 ' CD ' ' A' ' 181' ' ' GLU . 0.5 OUTLIER -70.18 -20.54 63.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 71.52 110.989 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 4.5 m -81.18 -35.52 31.31 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.538 1.149 . . . . 42.12 108.29 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -76.83 -14.88 59.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.07 -0.968 . . . . 75.34 110.866 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 tp -105.23 -44.92 4.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.247 -0.433 . . . . 72.22 110.93 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 43.3 t -89.65 -43.01 14.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.22 -0.445 . . . . 72.41 111.143 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -74.48 -142.07 0.75 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.742 -0.742 . . . . 73.11 112.429 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 11.3 mtp180 -128.87 24.09 5.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.875 0.369 . . . . 64.51 110.883 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -94.59 38.27 1.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 73.25 110.901 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -94.09 -34.18 13.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 65.41 110.865 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -104.99 7.3 34.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 72.14 110.837 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -79.72 -175.88 5.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.834 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.09 143.86 45.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.456 . . . . 74.24 110.958 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 209' ' ' VAL . . . . . 0.456 HG12 ' HA ' ' A' ' 187' ' ' CYS . 31.4 m -143.12 -176.39 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.233 -0.44 . . . . 74.44 111.169 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -120.93 105.4 10.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 71.53 111.071 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -92.41 -178.8 5.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.206 -0.452 . . . . 75.31 111.105 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.83 171.49 14.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.24 -0.437 . . . . 75.45 110.849 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.73 -175.32 2.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.113 -0.494 . . . . 73.44 110.848 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.106 -0.497 . . . . 61.45 110.917 -179.978 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 2.8 t . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.898 0.38 . . . . 73.23 110.851 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -120.43 55.11 1.03 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 71.5 110.889 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 58.5 mt -110.65 -59.47 3.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 53.14 111.092 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 62.75 179.36 0.14 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.192 -0.458 . . . . 74.33 110.874 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 145.32 -128.82 3.26 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.711 -0.757 . . . . 73.53 112.478 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.734 ' O ' HG22 ' A' ' 183' ' ' VAL . 1.5 mp -120.21 89.66 3.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.793 0.33 . . . . 72.13 110.907 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.52 -170.15 1.59 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.216 -0.447 . . . . 74.14 110.882 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -93.86 163.18 13.61 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.521 1.138 . . . . 71.12 108.318 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.97 -53.01 22.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.031 -0.986 . . . . 73.21 110.886 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.36 -36.81 22.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 75.34 110.891 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 178' ' ' HIS . . . . . 0.505 ' NE2' HD22 ' A' ' 197' ' ' LEU . 48.3 m80 -89.29 88.34 7.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.133 -0.485 . . . . 74.32 110.882 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.31 -23.99 46.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 74.45 110.918 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -95.4 34.57 1.43 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.097 -0.501 . . . . 74.24 110.888 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -152.3 172.83 15.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 52.25 110.884 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.11 139.11 53.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.097 -0.502 . . . . 63.41 110.834 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 183' ' ' VAL . . . . . 0.843 HG11 HD22 ' A' ' 193' ' ' LEU . 8.1 m -50.9 169.3 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 71.33 111.15 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -130.39 -43.09 1.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 74.0 110.857 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -154.46 -172.81 4.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 74.33 110.853 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -124.07 127.76 48.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.28 -0.418 . . . . 75.23 110.905 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -82.07 107.21 14.59 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.513 1.133 . . . . 52.31 108.3 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 40.2 t -73.71 -26.76 22.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 114.994 -1.003 . . . . 72.43 111.125 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 189' ' ' THR . . . . . 0.516 HG23 ' HB2' ' A' ' 208' ' ' GLN . 0.0 OUTLIER -62.1 -56.16 21.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.226 -0.443 . . . . 73.34 111.131 -179.875 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.32 -12.39 37.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 71.55 110.869 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 1.9 t70 64.27 58.61 1.1 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 65.35 110.874 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -159.22 118.35 2.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 72.05 110.85 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.843 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -50.74 148.83 3.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 45.32 110.856 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -147.41 -179.87 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.452 . . . . 73.04 111.144 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 23.3 p -123.46 -175.68 3.26 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.445 1.091 . . . . 45.4 108.339 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -71.82 -34.3 69.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.992 -1.004 . . . . 64.52 111.104 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.505 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.2 OUTLIER -69.5 -20.5 63.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 62.31 110.928 179.989 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 8.1 m -80.87 -35.99 31.91 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.477 1.11 . . . . 61.14 108.312 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 33.4 mtmt -77.17 -14.35 59.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.004 -0.998 . . . . 64.03 110.921 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.1 tp -105.14 -44.61 4.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.239 -0.437 . . . . 74.04 110.962 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 201' ' ' VAL . . . . . 0.446 HG21 ' CD2' ' A' ' 197' ' ' LEU . 44.1 t -89.68 -42.86 14.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.187 -0.46 . . . . 74.04 111.096 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.79 -140.67 0.91 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.72 -0.752 . . . . 74.54 112.47 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 80.0 mtm180 -132.51 22.78 4.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.853 0.359 . . . . 75.2 110.896 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -96.95 38.64 1.22 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.179 -0.464 . . . . 73.23 110.832 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 4.3 ttt85 -94.25 -43.95 8.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 65.13 110.839 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -93.71 7.13 45.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 73.35 110.812 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.8 m170 -79.78 174.84 11.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 73.15 110.852 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 208' ' ' GLN . . . . . 0.516 ' HB2' HG23 ' A' ' 189' ' ' THR . 0.5 OUTLIER -93.41 143.79 25.95 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.193 -0.458 . . . . 74.52 110.881 -179.926 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 29.9 m -150.32 -175.03 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 45.32 111.167 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -140.87 -169.84 2.9 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.211 -0.45 . . . . 55.32 111.073 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -142.08 -173.42 3.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 43.41 111.122 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -126.51 106.57 9.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.188 -0.46 . . . . 62.41 110.967 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.84 159.26 15.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 71.41 110.842 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 . . . . . 0 C--N 1.331 -0.232 0 CA-C-N 116.077 -0.51 . . . . 74.32 110.837 179.995 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.896 0.379 . . . . 63.52 110.899 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 4.4 m170 -97.27 -28.74 13.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.166 -0.47 . . . . 73.34 110.807 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 1.1 pp -54.16 -28.13 17.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.214 -0.448 . . . . 73.2 111.126 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.64 129.6 33.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.124 -0.489 . . . . 55.11 110.888 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 159.7 -51.21 0.38 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.761 -0.733 . . . . 72.31 112.538 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.48 ' O ' HG22 ' A' ' 183' ' ' VAL . 14.3 tp 63.53 106.22 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.821 0.343 . . . . 63.13 110.875 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 174' ' ' MET . . . . . 0.437 ' HA ' HG13 ' A' ' 183' ' ' VAL . 0.0 OUTLIER -110.06 174.45 5.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 63.41 110.826 179.776 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -55.02 163.28 1.07 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.544 1.153 . . . . 74.12 108.34 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.82 -54.69 10.65 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.048 -0.978 . . . . 73.42 110.917 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -84.22 -36.88 22.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 63.14 110.941 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 10.0 m170 -88.93 64.2 7.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 62.32 110.833 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -24.52 52.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 52.14 110.896 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -95.54 34.71 1.43 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 65.34 110.775 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.499 ' CD ' HD13 ' A' ' 197' ' ' LEU . 0.3 OUTLIER -154.71 103.48 2.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 74.41 110.96 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.5 151.98 9.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 71.24 110.94 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 183' ' ' VAL . . . . . 0.722 HG11 HD22 ' A' ' 193' ' ' LEU . 27.6 m -69.67 172.15 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.457 . . . . 63.24 111.073 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -129.46 -45.55 1.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 71.01 110.892 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.11 -170.1 3.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 72.2 110.895 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -123.59 129.25 50.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 74.24 110.902 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -85.78 106.4 17.0 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.548 1.155 . . . . 63.43 108.264 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 99.7 t -75.01 -39.89 44.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 114.948 -1.024 . . . . 70.4 111.127 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 1.2 t -51.34 -39.18 56.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 63.01 111.107 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -106.75 -9.5 16.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.296 -0.411 . . . . 63.2 110.841 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 5.7 t70 61.43 55.2 2.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 75.54 110.868 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.65 127.5 6.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 75.24 110.876 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.722 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -50.89 152.36 2.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.214 -0.448 . . . . 74.4 110.906 179.963 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -146.29 143.25 21.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.193 -0.458 . . . . 73.3 111.124 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 14.8 p -101.09 -175.4 2.86 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.554 1.159 . . . . 72.21 108.343 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -71.3 -41.28 70.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.062 -0.972 . . . . 72.11 111.11 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.499 HD13 ' CD ' ' A' ' 181' ' ' GLU . 0.4 OUTLIER -58.23 -25.35 61.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.288 -0.414 . . . . 73.04 110.919 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 62.9 m -81.22 -33.83 32.6 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.449 1.093 . . . . 64.24 108.301 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.38 -16.07 59.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.045 -0.979 . . . . 72.3 110.941 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.7 tp -105.68 -45.67 4.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 60.44 110.897 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 42.1 t -89.66 -43.21 14.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 73.51 111.192 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -72.86 -149.3 1.04 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.745 -0.74 . . . . 64.05 112.509 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.21 22.5 4.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.818 0.342 . . . . 63.2 110.843 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -90.04 47.94 1.51 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 64.3 110.901 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -94.07 -49.41 5.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.91 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -82.12 0.48 40.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.466 . . . . 75.24 110.864 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 38.6 m170 -79.85 120.9 24.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.252 -0.431 . . . . 72.22 110.821 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.53 153.9 18.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 73.05 110.931 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.5 m -147.7 -172.99 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 73.43 111.136 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -128.03 107.17 9.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 52.45 111.103 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -84.4 130.65 34.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.199 -0.455 . . . . 63.21 111.096 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 3.7 mp -77.2 171.78 14.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 72.44 110.899 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.2 t -175.88 114.39 0.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 75.33 110.889 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.109 -0.496 . . . . 53.4 110.91 179.987 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.983 0.421 . . . . 72.34 110.888 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -124.13 148.98 46.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.109 -0.496 . . . . 73.24 110.892 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 2.6 mp -119.57 -61.63 2.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 70.44 111.128 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 4.7 mtp180 -67.14 164.47 17.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.19 -0.459 . . . . 71.34 110.875 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 141.62 80.52 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.768 -0.73 . . . . 44.25 112.442 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 92.0 mt -133.16 77.57 1.74 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.79 0.329 . . . . 74.05 110.832 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -78.87 -173.07 3.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 75.31 110.811 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -77.01 162.0 27.89 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.566 1.166 . . . . 53.05 108.272 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.7 mp -71.62 -50.65 28.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.964 -1.017 . . . . 74.54 110.97 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -84.14 -38.74 20.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.183 -0.462 . . . . 72.41 110.894 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 178' ' ' HIS . . . . . 0.627 ' NE2' HD22 ' A' ' 197' ' ' LEU . 40.6 m80 -88.49 110.85 21.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 73.21 110.9 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -90.4 -32.99 16.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 61.1 110.915 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -95.23 34.78 1.37 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.074 -0.512 . . . . 74.1 110.862 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.608 ' HG3' HD12 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -154.32 106.54 2.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 75.12 110.881 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 8.2 mtpp -72.48 149.4 44.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.505 . . . . 70.24 110.882 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 183' ' ' VAL . . . . . 0.858 HG11 HD22 ' A' ' 193' ' ' LEU . 12.6 m -51.24 169.51 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.243 -0.435 . . . . 42.41 111.135 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -127.74 -38.76 1.85 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 72.31 110.909 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.3 -170.04 1.97 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 62.14 110.836 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -118.46 127.98 54.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 74.44 110.881 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -82.13 108.47 15.63 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.561 1.163 . . . . 72.21 108.248 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 61.6 t -73.81 -27.39 22.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 114.994 -1.003 . . . . 65.3 111.142 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.32 -55.78 24.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 52.44 111.113 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.58 -11.27 40.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.436 . . . . 63.13 110.842 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 18.4 t0 63.63 54.15 1.92 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 61.51 110.803 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -157.73 126.07 5.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.246 -0.434 . . . . 54.1 110.881 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.858 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.13 150.91 4.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 70.44 110.924 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.7 pp -149.88 -179.4 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 74.43 111.107 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 17.5 p -126.78 -175.63 3.46 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.431 1.082 . . . . 64.43 108.294 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -73.12 -38.24 66.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.064 -0.971 . . . . 63.33 111.145 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.627 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.3 OUTLIER -59.03 -27.43 65.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 72.22 110.969 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 67.6 m -81.01 -34.07 33.18 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.514 1.134 . . . . 71.01 108.3 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -76.22 -15.42 60.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.977 -1.01 . . . . 75.4 110.911 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.73 -45.54 4.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 71.1 110.92 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 201' ' ' VAL . . . . . 0.566 ' CG2' HD23 ' A' ' 197' ' ' LEU . 53.5 t -89.64 -43.0 14.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.158 -0.474 . . . . 42.33 111.143 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.58 -146.55 0.93 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.667 -0.778 . . . . 64.44 112.469 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 53.2 ttt180 -128.12 24.68 5.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.771 0.32 . . . . 75.23 110.884 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 62.2 m-70 -94.12 39.91 1.08 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 74.21 110.856 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 7.7 ttm-85 -87.34 -45.66 10.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 74.42 110.856 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -89.57 5.53 45.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.178 -0.465 . . . . 72.42 110.854 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 41.5 m170 -81.04 120.17 24.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.218 -0.446 . . . . 64.3 110.882 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.94 143.89 50.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 72.34 110.875 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 19.0 m -140.37 -173.58 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 73.04 111.098 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -117.48 102.69 9.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 73.5 111.117 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -89.03 93.34 9.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 72.11 111.106 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 1.3 tp 63.07 177.98 0.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 73.41 110.938 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 6.1 m -82.67 127.22 33.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.459 . . . . 75.25 110.839 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.141 -0.482 . . . . 73.32 110.893 179.986 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 49.1 m . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.891 0.377 . . . . 65.32 110.919 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 62.2 m80 -136.29 90.89 2.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 72.02 110.85 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 63.4 mt -121.92 94.51 2.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.19 -0.459 . . . . 61.11 111.124 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 4.6 mtt180 -97.1 38.1 1.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 64.32 110.834 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -79.75 141.44 23.57 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.714 -0.755 . . . . 44.1 112.568 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.592 ' O ' HG22 ' A' ' 183' ' ' VAL . 0.5 OUTLIER -129.35 100.16 5.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.813 0.34 . . . . 33.22 110.916 -179.797 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.21 -173.23 2.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 75.31 110.923 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -75.98 161.19 29.12 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.505 1.128 . . . . 51.52 108.307 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 10.6 mp -70.63 -51.74 25.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.027 -0.988 . . . . 70.32 110.989 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -84.03 -35.23 23.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.458 . . . . 64.33 110.899 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 22.6 m80 -94.64 93.74 7.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.106 -0.497 . . . . 70.13 110.859 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.03 -23.81 38.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.459 . . . . 74.01 110.857 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -95.44 34.62 1.43 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 75.04 110.872 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.75 112.98 1.94 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 50.02 110.894 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 14.4 pttt -72.11 146.08 47.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 71.05 110.882 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 183' ' ' VAL . . . . . 0.813 HG11 HD22 ' A' ' 193' ' ' LEU . 31.6 m -51.94 171.25 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.197 -0.456 . . . . 63.52 111.147 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -132.33 -38.72 1.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.169 -0.469 . . . . 63.22 110.89 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -158.61 -170.1 2.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 55.25 110.884 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -129.0 128.11 43.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 74.3 110.878 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -83.64 109.78 17.73 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.431 1.082 . . . . 74.43 108.294 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 39.6 t -75.27 -42.19 43.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 114.961 -1.018 . . . . 75.43 111.068 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 189' ' ' THR . . . . . 0.403 HG23 ' N ' ' A' ' 190' ' ' ASP . 3.5 t -51.69 -44.14 63.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 74.33 111.113 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 190' ' ' ASP . . . . . 0.403 ' N ' HG23 ' A' ' 189' ' ' THR . 9.0 m-20 -97.5 -14.95 20.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 73.14 110.868 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.85 56.54 1.86 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 63.34 110.847 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -158.77 120.36 3.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.465 . . . . 75.44 110.927 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.813 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.25 148.91 5.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 72.24 110.875 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -144.88 -179.77 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.19 -0.459 . . . . 61.44 111.072 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.1 p -126.82 -175.52 3.43 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.592 1.183 . . . . 75.24 108.34 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.87 -32.68 65.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.002 -0.999 . . . . 45.35 111.077 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.86 -21.09 62.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 71.14 110.955 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 6.8 m -81.17 -35.35 31.55 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.485 1.116 . . . . 64.12 108.333 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? -76.96 -14.69 59.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.987 -1.006 . . . . 71.24 110.945 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.2 tp -105.38 -44.82 4.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 73.32 110.878 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 44.1 t -89.71 -42.91 14.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 61.44 111.131 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.54 -142.45 1.02 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.78 -0.724 . . . . 60.51 112.467 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 5.2 mtt85 -132.38 23.27 4.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.879 0.371 . . . . 71.33 110.881 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -94.55 38.36 1.11 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.162 -0.472 . . . . 70.3 110.825 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -94.22 -42.46 8.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.246 -0.433 . . . . 65.34 110.809 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -94.85 7.19 46.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.222 -0.444 . . . . 50.2 110.874 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.3 m170 -79.84 176.13 10.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 63.42 110.857 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.91 143.94 26.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 74.13 110.889 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 32.8 m -150.24 -175.61 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 73.52 111.198 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -143.21 106.93 4.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 72.1 111.072 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -76.63 137.39 39.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.259 -0.428 . . . . 64.45 111.126 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.92 164.39 14.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 71.31 110.885 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 68.7 m -111.06 47.16 1.01 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 64.41 110.885 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.142 -0.481 . . . . 62.45 110.852 -179.971 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 3.2 t . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.957 0.408 . . . . 71.01 110.862 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 3.6 p80 -119.71 39.08 3.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.065 -0.516 . . . . 71.24 110.837 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 58.4 mt -108.62 -28.72 2.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 61.14 111.097 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 41.9 mtt180 54.46 90.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 73.42 110.889 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 159.36 -161.57 32.2 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.737 -0.744 . . . . 64.32 112.508 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.559 ' O ' HG22 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -143.61 46.56 1.48 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.812 0.339 . . . . 71.35 110.895 -179.855 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -105.23 -174.0 2.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 71.23 110.937 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -81.36 160.96 23.98 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.481 1.113 . . . . 74.45 108.269 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.0 mp -76.43 -45.96 29.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.927 -1.033 . . . . 63.5 110.944 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -84.4 -34.79 23.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 73.31 110.854 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 178' ' ' HIS . . . . . 0.747 ' CD2' HD22 ' A' ' 197' ' ' LEU . 37.8 m80 -99.44 78.49 2.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.137 -0.483 . . . . 75.22 110.878 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -62.74 -31.1 71.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.235 -0.438 . . . . 75.31 110.919 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -94.31 34.72 1.25 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.171 -0.468 . . . . 63.44 110.806 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.69 112.83 3.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.279 -0.418 . . . . 63.2 110.916 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 18.3 mtpt -72.51 144.62 47.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.185 -0.461 . . . . 61.51 110.845 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 183' ' ' VAL . . . . . 0.796 HG11 HD22 ' A' ' 193' ' ' LEU . 29.3 m -51.51 170.56 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.19 -0.459 . . . . 74.44 111.18 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -131.85 -38.71 1.12 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.449 . . . . 63.04 110.912 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.69 -170.03 2.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.197 -0.456 . . . . 74.32 110.868 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -128.54 127.98 43.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 75.14 110.949 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -83.72 109.84 17.82 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.45 1.094 . . . . 70.51 108.265 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 22.0 t -75.23 -42.11 44.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 114.939 -1.028 . . . . 71.35 111.132 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 189' ' ' THR . . . . . 0.402 HG23 ' N ' ' A' ' 190' ' ' ASP . 3.5 t -51.69 -44.07 63.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 72.42 111.154 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 190' ' ' ASP . . . . . 0.402 ' N ' HG23 ' A' ' 189' ' ' THR . 9.4 m-20 -97.56 -15.03 20.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.157 -0.474 . . . . 62.44 110.843 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 62.85 56.54 1.86 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.189 -0.46 . . . . 72.22 110.913 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -159.04 120.25 3.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 74.31 110.917 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.796 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.17 148.87 5.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 75.51 110.905 -179.961 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -145.37 -179.63 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 75.02 111.099 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 25.6 p -126.74 -175.55 3.44 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.544 1.153 . . . . 72.21 108.317 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.81 -33.03 65.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.97 -1.014 . . . . 75.32 111.131 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.747 HD22 ' CD2' ' A' ' 178' ' ' HIS . 0.1 OUTLIER -70.43 -20.98 62.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.45 . . . . 63.44 110.947 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 7.7 m -81.26 -35.44 31.16 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.52 1.138 . . . . 74.22 108.288 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 26.0 mtmt -77.02 -14.77 59.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.99 -1.004 . . . . 75.33 110.886 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.3 tp -105.18 -44.7 4.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.232 -0.44 . . . . 71.04 110.938 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 201' ' ' VAL . . . . . 0.636 HG21 HD23 ' A' ' 197' ' ' LEU . 44.3 t -89.71 -42.81 14.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 72.12 111.075 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.96 -141.64 1.06 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.733 -0.746 . . . . 44.1 112.455 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 58.2 mtp180 -132.65 23.62 4.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.806 0.336 . . . . 73.25 110.819 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -94.78 37.95 1.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.235 -0.439 . . . . 64.41 110.894 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -94.14 -42.06 9.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.25 -0.432 . . . . 75.24 110.865 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 13.4 p-10 -95.34 7.14 47.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 64.12 110.895 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -79.79 177.16 9.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 74.2 110.913 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -96.99 143.94 27.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 54.23 110.932 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 34.5 m -150.4 -175.99 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 63.43 111.128 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -135.68 119.27 17.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 71.34 111.083 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -95.62 113.47 25.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 51.31 111.111 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.86 158.56 33.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.281 -0.418 . . . . 73.32 110.893 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.92 146.32 45.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.451 . . . . 73.0 110.873 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.462 . . . . 73.44 110.9 -179.977 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.91 0.386 . . . . 63.33 110.883 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 10.5 m-70 -100.82 -50.55 3.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 74.4 110.869 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 10.5 pt -126.0 146.83 31.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.155 -0.475 . . . . 63.32 111.106 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.92 146.23 40.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 74.53 110.846 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 148.24 -35.88 1.13 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.724 -0.75 . . . . 42.5 112.513 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.48 ' O ' HG22 ' A' ' 183' ' ' VAL . 1.9 tp 63.54 106.4 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.844 0.354 . . . . 73.32 110.937 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.04 -169.93 1.56 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.265 -0.425 . . . . 74.21 110.833 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.39 160.93 25.21 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.445 1.091 . . . . 72.31 108.283 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 2.5 mp -66.3 -55.29 16.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.984 -1.007 . . . . 73.23 110.929 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -84.35 -33.73 23.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.249 -0.432 . . . . 64.1 110.895 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -94.6 75.01 3.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 74.1 110.832 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -25.42 67.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 51.14 110.895 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.55 34.6 1.45 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.107 -0.497 . . . . 73.24 110.86 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -130.47 -172.61 2.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 61.35 110.916 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.9 mttp -136.95 120.88 17.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.226 -0.443 . . . . 65.22 110.896 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 183' ' ' VAL . . . . . 0.48 HG22 ' O ' ' A' ' 173' ' ' LEU . 19.8 m -51.31 165.03 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 72.33 111.183 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -134.05 -50.87 0.83 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 64.13 110.844 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 185' ' ' MET . . . . . 0.425 ' O ' HD23 ' A' ' 193' ' ' LEU . 0.0 OUTLIER -154.88 -170.1 3.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.187 -0.46 . . . . 55.34 110.932 179.998 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -127.12 129.56 48.16 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.323 -0.398 . . . . 70.11 110.951 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.33 105.31 14.18 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.477 1.111 . . . . 73.42 108.24 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 58.8 t -73.27 -26.16 22.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 114.966 -1.015 . . . . 74.45 111.12 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.6 -55.79 20.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 63.31 111.198 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -89.76 -10.32 46.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 40.44 110.866 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 6.1 t70 64.15 58.25 1.17 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.177 -0.465 . . . . 63.0 110.862 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -160.22 127.13 4.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 52.51 110.893 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.425 HD23 ' O ' ' A' ' 185' ' ' MET . 0.2 OUTLIER -51.35 152.64 2.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 40.24 110.962 179.985 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 194' ' ' ILE . . . . . 0.557 HD11 HG11 ' A' ' 209' ' ' VAL . 1.0 OUTLIER -144.84 142.77 22.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 73.33 111.087 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 14.8 p -107.12 -174.32 2.51 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.475 1.109 . . . . 72.23 108.31 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.37 -44.45 78.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.032 -0.985 . . . . 72.41 111.088 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -20.35 62.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.449 . . . . 75.04 110.914 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 24.8 m -80.82 -32.55 35.16 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.497 1.123 . . . . 75.24 108.325 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 4.5 mtpm? -77.34 -15.85 59.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.027 -0.988 . . . . 73.13 110.9 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.6 tp -105.38 -44.85 4.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.463 . . . . 61.03 110.912 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 61.5 t -89.82 -42.57 14.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.215 -0.448 . . . . 73.2 111.118 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -78.25 -148.79 3.89 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.739 -0.743 . . . . 15.33 112.478 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 8.3 ttm180 -134.25 24.75 3.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.799 0.333 . . . . 74.03 110.841 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 204' ' ' HIS . . . . . 0.506 ' CG ' HG21 ' A' ' 194' ' ' ILE . 92.5 m-70 -95.47 38.84 1.14 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 74.01 110.858 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 3.6 ttp85 -94.22 -48.0 6.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.244 -0.434 . . . . 70.34 110.842 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -90.39 7.36 39.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 64.01 110.867 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 31.5 m170 -79.94 175.01 11.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 74.54 110.896 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 52.0 mm-40 -95.03 147.55 23.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.29 -0.414 . . . . 70.43 110.952 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 209' ' ' VAL . . . . . 0.557 HG11 HD11 ' A' ' 194' ' ' ILE . 35.9 m -150.33 -176.06 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 53.14 111.128 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -121.99 101.96 7.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.46 . . . . 64.41 111.132 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -66.81 146.53 54.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 55.01 111.133 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.01 124.6 29.92 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.228 -0.442 . . . . 54.13 110.865 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 6.1 p -96.2 168.18 10.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.128 -0.487 . . . . 72.41 110.779 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 116.098 -0.501 . . . . 54.21 110.873 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.843 0.354 . . . . 72.43 110.898 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -83.92 -60.51 2.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 73.42 110.804 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 9.5 tp -59.46 133.81 24.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 75.52 111.116 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.07 -174.3 1.22 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 75.52 110.827 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 132.56 129.62 3.02 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.697 -0.763 . . . . 21.11 112.506 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -119.87 95.57 4.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.821 0.343 . . . . 74.0 110.929 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -52.18 165.25 0.23 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.161 -0.472 . . . . 75.11 110.944 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -54.9 161.26 1.66 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.494 1.121 . . . . 45.52 108.301 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.2 mp -68.63 -54.77 14.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.969 -1.014 . . . . 71.31 110.905 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -83.98 -35.43 23.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.167 -0.469 . . . . 72.32 110.926 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 16.3 m80 -93.41 62.52 3.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.122 -0.49 . . . . 72.34 110.854 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -57.82 -23.6 53.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 72.33 110.947 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.45 34.6 1.43 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.122 -0.49 . . . . 64.54 110.809 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -151.47 89.29 1.48 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 73.42 110.872 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.97 121.0 5.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.103 -0.499 . . . . 71.25 110.916 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 183' ' ' VAL . . . . . 0.838 HG11 HD22 ' A' ' 193' ' ' LEU . 16.7 m -51.74 163.79 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.445 . . . . 73.0 111.129 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -117.41 -36.77 3.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.15 110.849 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -162.58 -168.54 1.85 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 71.24 110.813 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.718 ' CZ ' HG22 ' A' ' 188' ' ' VAL . 0.2 OUTLIER -132.52 138.64 47.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 65.12 110.905 -179.929 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -74.59 116.43 15.27 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.539 1.149 . . . . 62.13 108.245 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 188' ' ' VAL . . . . . 0.718 HG22 ' CZ ' ' A' ' 186' ' ' TYR . 68.7 t -74.74 -38.47 44.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 114.972 -1.013 . . . . 63.21 111.083 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.98 -53.64 55.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 74.33 111.173 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -86.14 -10.36 54.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 71.22 110.859 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 34.2 t70 57.31 50.38 11.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 73.25 110.815 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -148.61 127.33 12.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 53.3 110.913 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.838 HD22 HG11 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -51.17 150.78 3.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.224 -0.444 . . . . 74.55 110.878 -179.958 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 194' ' ' ILE . . . . . 0.439 HG23 ' O ' ' A' ' 193' ' ' LEU . 1.0 OUTLIER -155.67 142.82 11.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.197 -0.456 . . . . 65.24 111.127 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 25.5 p -97.79 -175.02 3.05 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.488 1.118 . . . . 40.21 108.279 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.2 -33.73 67.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.934 -1.03 . . . . 63.51 111.079 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.22 -24.75 65.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.261 -0.427 . . . . 73.1 110.904 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 34.5 m -80.95 -31.69 34.82 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.499 1.124 . . . . 74.21 108.291 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 41.4 mtpt -77.16 -16.59 59.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.981 -1.009 . . . . 71.34 110.971 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.3 tp -105.48 -45.22 4.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.193 -0.458 . . . . 72.43 110.929 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 61.9 t -89.87 -42.69 14.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.451 . . . . 72.41 111.117 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -72.35 -147.37 0.71 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.706 -0.759 . . . . 70.25 112.484 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.0 21.74 6.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.838 0.352 . . . . 74.44 110.886 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -95.97 39.69 1.14 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.111 -0.495 . . . . 74.02 110.93 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -94.18 -40.89 9.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.237 -0.438 . . . . 74.23 110.901 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.37 7.15 46.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 60.13 110.792 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.8 m170 -83.19 -175.26 5.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.262 -0.426 . . . . 72.11 110.877 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -117.01 147.22 42.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 75.21 110.883 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 17.9 m -139.71 -173.21 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.452 . . . . 74.44 111.15 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -105.92 -169.43 1.58 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 72.25 111.098 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -154.84 144.88 21.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 74.23 111.058 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.97 169.85 9.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.446 . . . . 64.12 110.938 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 94.6 p -155.05 146.26 22.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 73.12 110.825 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 73.23 110.843 179.979 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 27.7 t . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.888 0.375 . . . . 75.31 110.885 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.3 135.65 55.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 71.21 110.856 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 4.3 pt -135.67 71.46 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 71.43 111.133 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 63.14 95.13 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.217 -0.447 . . . . 54.31 110.889 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 158.41 90.49 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.732 -0.747 . . . . 50.25 112.494 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.56 104.92 13.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.821 0.343 . . . . 74.23 110.926 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -52.08 154.96 2.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.46 . . . . 62.13 110.829 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.3 164.17 1.01 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.521 1.138 . . . . 73.41 108.33 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.4 mp -77.02 -48.03 19.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.98 -1.009 . . . . 64.11 110.918 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -84.17 -43.27 15.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 72.21 110.858 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 178' ' ' HIS . . . . . 0.484 ' CD2' HD13 ' A' ' 197' ' ' LEU . 20.7 m80 -89.77 62.11 5.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 75.21 110.869 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -52.24 -29.77 24.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.177 -0.465 . . . . 42.01 110.912 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -93.91 35.01 1.17 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 62.32 110.913 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.697 ' HG3' HD12 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -151.77 96.57 2.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 73.12 110.872 -179.851 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.48 126.38 27.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 73.1 110.902 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 183' ' ' VAL . . . . . 0.842 HG11 HD22 ' A' ' 193' ' ' LEU . 16.8 m -51.77 163.34 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.434 . . . . 74.43 111.102 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -118.96 -37.41 3.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 71.11 110.878 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.21 -168.45 2.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 73.15 110.831 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.748 ' CZ ' HG22 ' A' ' 188' ' ' VAL . 0.4 OUTLIER -132.71 138.69 47.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 72.21 110.947 -179.874 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.65 113.75 10.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.575 1.172 . . . . 64.2 108.359 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 188' ' ' VAL . . . . . 0.748 HG22 ' CZ ' ' A' ' 186' ' ' TYR . 60.5 t -74.21 -28.67 23.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.003 -0.998 . . . . 72.53 111.107 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.73 -56.34 16.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.453 . . . . 43.45 111.141 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.36 -4.59 55.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.246 -0.434 . . . . 72.41 110.843 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 6.2 t70 57.05 50.64 11.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 73.03 110.862 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.52 127.41 17.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 72.24 110.929 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.842 HD22 HG11 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -51.64 150.67 3.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.162 -0.472 . . . . 72.21 110.919 -179.981 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 194' ' ' ILE . . . . . 0.462 HG23 ' O ' ' A' ' 193' ' ' LEU . 1.0 OUTLIER -156.45 142.57 10.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 70.44 111.163 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 20.8 p -97.47 -175.1 3.1 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.434 1.084 . . . . 71.5 108.31 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.02 -35.9 69.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.971 -1.013 . . . . 60.4 111.081 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.697 HD12 ' HG3' ' A' ' 181' ' ' GLU . 0.2 OUTLIER -64.98 -24.71 67.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 61.12 110.883 -179.983 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 37.0 m -81.08 -32.39 33.97 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.422 1.076 . . . . 52.23 108.27 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 30.9 mtmt -76.45 -16.53 59.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.99 -1.005 . . . . 73.42 110.842 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.3 tp -105.74 -45.51 4.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 61.13 110.939 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 201' ' ' VAL . . . . . 0.627 ' CG2' HD23 ' A' ' 197' ' ' LEU . 53.0 t -89.73 -42.93 14.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.16 -0.473 . . . . 74.41 111.197 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -71.79 -149.2 0.76 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.743 -0.742 . . . . 53.45 112.462 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.52 20.7 6.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.808 0.337 . . . . 74.24 110.874 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -96.71 39.38 1.17 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 74.33 110.907 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.08 -47.94 6.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 41.24 110.882 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.76 2.03 39.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.223 -0.444 . . . . 75.32 110.891 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 36.3 m170 -79.98 -176.46 5.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 73.42 110.876 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.09 144.61 42.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.196 -0.456 . . . . 64.02 110.884 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.9 m -135.57 -175.23 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.205 -0.452 . . . . 72.44 111.124 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -107.91 79.98 1.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.097 -0.501 . . . . 75.02 111.038 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -93.78 119.73 33.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.281 -0.418 . . . . 53.13 111.074 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 59.15 -177.1 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 73.3 110.891 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -163.44 107.9 1.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 73.2 110.856 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.16 -0.473 . . . . 65.52 110.831 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 17.9 m . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.888 0.375 . . . . 44.21 110.836 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 59.3 m-70 -98.22 135.64 39.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 72.21 110.843 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 2.1 pt -133.25 37.4 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.444 . . . . 72.22 111.142 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.8 -27.53 30.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 73.31 110.853 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -59.47 124.39 36.27 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.809 -0.71 . . . . 72.44 112.521 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.33 98.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.901 0.382 . . . . 44.14 110.931 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.93 166.4 0.15 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 51.21 110.862 179.785 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -61.75 162.01 9.3 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.496 1.122 . . . . 60.33 108.271 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 3.9 mp -68.25 -53.1 26.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.98 -1.009 . . . . 72.33 110.94 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -84.27 -35.39 23.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 61.23 110.879 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 178' ' ' HIS . . . . . 0.522 ' NE2' HD22 ' A' ' 197' ' ' LEU . 32.4 m80 -91.98 71.03 5.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 70.13 110.884 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -24.36 67.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.203 -0.453 . . . . 71.05 110.914 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -95.44 34.73 1.41 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.481 . . . . 74.55 110.77 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.521 ' OE1' HD13 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -140.1 -169.3 2.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 74.35 110.892 -179.978 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 9.7 tttt -140.71 127.61 20.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.485 . . . . 72.25 110.855 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 183' ' ' VAL . . . . . 0.787 HG11 HD22 ' A' ' 193' ' ' LEU . 3.3 m -50.61 167.81 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 70.0 111.081 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 39.6 t-20 -127.82 -38.08 1.89 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 73.43 110.856 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 1.2 mmt -164.17 -171.63 2.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 71.32 110.863 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.401 ' O ' HG12 ' A' ' 209' ' ' VAL . 51.3 t80 -117.07 126.93 53.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.216 -0.447 . . . . 71.21 110.954 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -83.43 107.06 15.68 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.45 1.094 . . . . 73.24 108.281 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 60.4 t -75.49 -41.27 42.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.011 -0.995 . . . . 64.13 111.1 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 189' ' ' THR . . . . . 0.544 HG23 ' OD2' ' A' ' 190' ' ' ASP . 1.2 t -50.49 -34.76 26.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.476 . . . . 71.34 111.079 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 190' ' ' ASP . . . . . 0.544 ' OD2' HG23 ' A' ' 189' ' ' THR . 1.1 m-20 -111.73 -9.44 14.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.266 -0.424 . . . . 54.52 110.827 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 9.2 t0 60.23 55.18 3.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 72.23 110.935 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -158.37 125.99 5.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.126 -0.488 . . . . 73.43 110.942 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.787 HD22 HG11 ' A' ' 183' ' ' VAL . 0.1 OUTLIER -57.1 149.18 19.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.457 . . . . 72.35 110.904 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -150.32 -179.28 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 63.53 111.119 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 27.6 p -123.51 -175.51 3.22 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.509 1.131 . . . . 64.11 108.225 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -73.29 -32.28 64.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.983 -1.008 . . . . 61.11 111.06 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.522 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.3 OUTLIER -65.64 -25.5 67.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 74.32 110.951 -179.991 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 57.8 m -81.03 -35.45 31.86 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 124.568 1.168 . . . . 72.32 108.311 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 4.0 mtmt -76.91 -14.76 59.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.976 -1.011 . . . . 70.44 110.869 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.8 tp -105.38 -45.0 4.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.266 -0.425 . . . . 74.13 110.903 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 43.6 t -89.64 -43.0 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 62.21 111.122 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.94 -142.28 0.67 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.715 -0.755 . . . . 70.43 112.478 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -128.26 23.17 6.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.766 0.317 . . . . 72.44 110.896 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 -97.86 39.56 1.21 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.162 -0.472 . . . . 75.41 110.898 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -84.48 -40.51 17.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 71.2 110.859 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -97.95 7.05 46.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 65.3 110.905 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 207' ' ' HIS . . . . . 0.431 ' CG ' HG21 ' A' ' 189' ' ' THR . 39.3 m170 -80.5 120.48 24.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 74.14 110.813 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -59.64 163.66 4.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 73.03 110.913 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 209' ' ' VAL . . . . . 0.401 HG12 ' O ' ' A' ' 186' ' ' TYR . 14.0 m -149.11 -176.32 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 73.01 111.137 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -105.86 39.73 1.72 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.2 -0.455 . . . . 65.1 111.138 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -69.24 131.24 44.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 74.23 111.091 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 2.8 mp -74.6 170.81 15.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 74.21 110.947 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.3 p -100.78 175.59 5.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.211 -0.449 . . . . 53.31 110.855 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 72.54 110.916 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.941 0.4 . . . . 52.02 110.802 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 169' ' ' HIS . . . . . 0.535 ' C ' HD12 ' A' ' 170' ' ' ILE . 33.5 p80 -102.58 -28.55 12.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.067 -0.515 . . . . 74.32 110.824 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 170' ' ' ILE . . . . . 0.535 HD12 ' C ' ' A' ' 169' ' ' HIS . 1.9 mp 70.99 -70.41 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.439 . . . . 74.44 111.072 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -120.44 -50.68 2.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 72.21 110.877 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 134.2 166.99 11.4 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.748 -0.739 . . . . 65.41 112.452 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.614 ' O ' HG22 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -108.31 73.58 0.89 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.796 0.332 . . . . 73.32 110.926 -179.868 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.44 -169.48 1.47 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 74.13 110.888 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.32 161.59 16.28 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.499 1.124 . . . . 73.0 108.31 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.76 -53.26 34.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.008 -0.996 . . . . 75.31 110.946 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -84.62 -36.35 22.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 71.45 110.869 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 34.0 m80 -91.47 88.94 7.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 64.32 110.776 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -78.5 -25.46 45.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 63.43 110.86 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -95.5 34.58 1.44 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 74.5 110.896 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -141.3 179.57 6.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 75.32 110.908 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.14 128.34 41.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 73.34 110.88 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 183' ' ' VAL . . . . . 0.794 HG11 HD22 ' A' ' 193' ' ' LEU . 22.8 m -50.81 168.0 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.157 -0.474 . . . . 63.12 111.165 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -127.6 -38.49 1.9 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.258 -0.428 . . . . 63.42 110.893 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -164.52 -170.15 1.96 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 62.34 110.831 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -120.11 127.4 52.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 72.15 110.956 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -80.67 108.05 13.99 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.446 1.091 . . . . 53.34 108.268 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 53.1 t -73.8 -28.49 24.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 114.955 -1.02 . . . . 63.34 111.191 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -55.6 28.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.133 -0.485 . . . . 73.11 111.191 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.5 -11.31 40.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 52.51 110.84 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 4.8 t70 63.51 55.05 1.82 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 75.43 110.889 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -157.39 125.12 5.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 72.52 110.88 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.794 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.86 148.87 6.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.24 -0.436 . . . . 65.35 110.864 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.2 pp -147.24 -179.88 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 51.5 111.133 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 22.1 p -126.97 -175.67 3.49 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.465 1.103 . . . . 61.54 108.291 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -71.89 -34.68 69.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.992 -1.004 . . . . 53.54 111.123 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -23.69 67.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 64.12 110.942 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 51.7 m -80.97 -36.08 31.3 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.54 1.15 . . . . 73.41 108.317 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.74 -14.7 59.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.939 -1.028 . . . . 65.44 110.929 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.4 tp -105.19 -44.99 4.62 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.213 -0.448 . . . . 53.45 110.89 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 42.1 t -89.54 -43.08 14.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 71.42 111.104 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.71 -142.41 1.07 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.753 -0.737 . . . . 70.02 112.517 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 3.3 mtp85 -132.98 24.77 4.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.831 0.348 . . . . 74.55 110.827 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 50.1 m-70 -93.8 40.73 1.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 74.03 110.832 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 9.3 ptt85 -89.07 -39.74 13.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.277 -0.42 . . . . 71.25 110.875 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -94.8 3.8 54.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.199 -0.455 . . . . 73.1 110.851 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 48.5 m170 -79.95 120.18 23.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 74.3 110.855 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.84 143.89 50.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 62.22 110.891 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.7 m -139.69 -173.4 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.475 . . . . 55.41 111.089 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -123.46 113.53 18.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.231 -0.44 . . . . 30.42 111.097 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -71.68 152.96 42.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.273 -0.421 . . . . 65.22 111.066 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.26 142.19 45.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 64.53 110.878 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.5 p -165.27 133.89 3.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.116 -0.493 . . . . 52.11 110.852 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 63.4 110.925 -179.98 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 39.9 m . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.936 0.398 . . . . 71.31 110.859 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 33.8 p-80 -126.27 39.89 3.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 73.54 110.826 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 20.1 tt -115.88 -26.88 2.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.213 -0.448 . . . . 73.52 111.085 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 38.6 ttp85 -62.52 124.61 21.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 65.52 110.873 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -141.17 -167.75 11.22 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.765 -0.731 . . . . 60.11 112.524 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.664 ' O ' HG22 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -108.34 102.29 11.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.851 0.358 . . . . 75.44 110.936 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.21 -171.57 1.86 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 65.42 110.861 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -95.05 160.98 14.32 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 75.01 108.267 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.25 -55.63 20.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.961 -1.018 . . . . 62.54 110.883 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -84.56 -33.63 23.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.429 . . . . 73.21 110.859 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 178' ' ' HIS . . . . . 0.615 ' NE2' HD22 ' A' ' 197' ' ' LEU . 28.2 m80 -94.96 65.85 2.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.476 . . . . 74.31 110.872 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.64 -28.48 67.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.435 . . . . 64.4 110.9 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -93.23 35.1 1.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 52.21 110.843 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.402 ' OE2' HD12 ' A' ' 197' ' ' LEU . 0.4 OUTLIER -135.54 175.31 9.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 72.41 110.883 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.63 113.55 13.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 72.51 110.92 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 183' ' ' VAL . . . . . 0.789 HG11 HD22 ' A' ' 193' ' ' LEU . 16.0 m -51.43 160.94 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.424 . . . . 61.5 111.151 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -122.87 -39.21 2.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 74.42 110.826 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 185' ' ' MET . . . . . 0.405 ' O ' HD23 ' A' ' 193' ' ' LEU . 0.0 OUTLIER -156.26 -169.4 3.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.471 . . . . 53.54 110.845 179.971 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.623 ' CE1' HG22 ' A' ' 188' ' ' VAL . 0.3 OUTLIER -133.31 138.84 46.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.224 -0.444 . . . . 71.24 110.894 -179.864 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.66 114.79 12.31 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.495 1.122 . . . . 75.45 108.274 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 188' ' ' VAL . . . . . 0.623 HG22 ' CE1' ' A' ' 186' ' ' TYR . 20.7 t -74.29 -30.53 26.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 114.992 -1.004 . . . . 73.43 111.145 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.58 -56.08 21.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 73.55 111.18 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.59 -5.2 56.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.265 -0.425 . . . . 74.21 110.921 179.853 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 23.8 t70 56.59 50.08 13.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 70.13 110.893 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -143.81 127.32 16.94 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.143 -0.48 . . . . 74.23 110.916 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.789 HD22 HG11 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -51.33 151.02 3.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 73.44 110.944 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 194' ' ' ILE . . . . . 0.46 HG23 ' O ' ' A' ' 193' ' ' LEU . 1.0 OUTLIER -156.32 142.84 10.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 72.51 111.148 179.865 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.2 p -97.75 -175.19 3.1 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.524 1.14 . . . . 71.34 108.322 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.29 -32.69 66.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.0 -1.0 . . . . 33.11 111.118 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.615 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.2 OUTLIER -70.31 -22.2 62.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.26 -0.427 . . . . 71.34 110.858 -179.992 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 12.8 m -80.89 -33.6 34.16 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.446 1.091 . . . . 52.4 108.363 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -76.91 -15.6 59.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.977 -1.011 . . . . 74.12 110.9 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.9 tp -105.58 -45.15 4.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 73.24 110.879 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 201' ' ' VAL . . . . . 0.406 HG21 ' CD2' ' A' ' 197' ' ' LEU . 48.2 t -89.66 -42.8 14.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 53.55 111.207 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.48 -145.0 0.75 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.708 -0.758 . . . . 61.42 112.474 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -129.58 21.55 5.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.79 0.328 . . . . 74.33 110.907 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -99.28 39.86 1.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.244 -0.435 . . . . 51.42 110.864 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -94.24 -48.19 6.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 73.35 110.854 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -84.54 2.87 39.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.243 -0.435 . . . . 60.24 110.899 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.0 m170 -80.22 -176.75 5.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.461 . . . . 73.12 110.854 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -112.92 151.81 30.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 73.02 110.901 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.9 m -143.01 -175.88 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.462 . . . . 72.53 111.122 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -107.68 85.1 2.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 70.13 111.064 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -75.68 132.29 40.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 62.03 111.105 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.48 150.42 23.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 63.24 110.948 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 33.3 t -130.32 128.19 41.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.451 . . . . 70.3 110.848 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 70.41 110.891 179.985 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 66.4 m . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.86 0.362 . . . . 70.54 110.888 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -152.61 -54.79 0.12 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 74.2 110.871 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 5.3 pt -110.47 72.36 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.225 -0.443 . . . . 74.21 111.064 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -133.13 148.03 52.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.434 . . . . 72.23 110.817 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -96.47 64.9 1.08 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.787 -0.721 . . . . 73.45 112.498 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.5 115.93 3.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.752 0.311 . . . . 55.24 110.881 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -52.09 155.44 1.9 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.177 -0.465 . . . . 61.12 110.892 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.92 161.0 1.76 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.505 1.128 . . . . 73.4 108.332 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 10.5 mp -73.58 -47.92 36.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.048 -0.978 . . . . 70.12 110.906 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -84.21 -42.26 16.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.213 -0.448 . . . . 74.1 110.875 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 178' ' ' HIS . . . . . 0.72 ' CD2' HD22 ' A' ' 197' ' ' LEU . 24.0 m80 -91.89 62.11 4.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.078 -0.51 . . . . 72.34 110.828 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.44 -29.88 26.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 74.13 110.858 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -93.99 34.98 1.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.156 -0.475 . . . . 73.04 110.942 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.8 96.68 2.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.149 -0.478 . . . . 74.5 110.848 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -56.76 132.67 52.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 74.4 110.899 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 183' ' ' VAL . . . . . 0.854 HG11 HD22 ' A' ' 193' ' ' LEU . 20.0 m -61.3 165.73 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 71.14 111.149 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -119.65 -35.54 3.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 74.24 110.864 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -162.43 -168.27 1.8 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 70.02 110.934 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.748 ' CZ ' HG22 ' A' ' 188' ' ' VAL . 0.3 OUTLIER -132.6 138.51 47.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.289 -0.414 . . . . 62.31 110.931 -179.855 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.8 114.08 10.55 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.506 1.129 . . . . 51.02 108.278 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 188' ' ' VAL . . . . . 0.748 HG22 ' CZ ' ' A' ' 186' ' ' TYR . 60.1 t -74.32 -29.55 24.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 114.972 -1.013 . . . . 71.51 111.083 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -56.23 18.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 75.23 111.171 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -90.79 -5.1 56.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 61.35 110.895 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 3.7 t0 56.99 50.62 11.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 74.45 110.851 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -144.06 127.34 16.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 43.03 110.899 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.854 HD22 HG11 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -51.58 150.27 3.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.243 -0.435 . . . . 71.35 110.882 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 194' ' ' ILE . . . . . 0.454 HG23 ' O ' ' A' ' 193' ' ' LEU . 1.0 OUTLIER -156.27 142.6 10.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.194 -0.457 . . . . 74.42 111.157 179.849 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.5 p -95.8 -175.21 3.36 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 74.44 108.279 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.31 -32.72 66.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.993 -1.003 . . . . 63.0 111.096 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.72 HD22 ' CD2' ' A' ' 178' ' ' HIS . 0.1 OUTLIER -69.02 -24.04 64.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 72.43 110.859 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 23.4 m -81.27 -31.32 33.73 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.514 1.134 . . . . 45.44 108.336 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -76.46 -17.54 59.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.002 -0.999 . . . . 65.14 110.873 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.9 tp -105.99 -45.88 4.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 72.22 110.922 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 44.6 t -89.81 -43.3 14.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.203 -0.453 . . . . 34.24 111.106 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -67.72 -153.8 0.42 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 74.45 112.551 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -120.08 19.29 12.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.818 0.342 . . . . 54.51 110.852 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -96.26 47.49 1.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 70.11 110.861 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.11 -51.16 4.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.23 -0.441 . . . . 73.43 110.843 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.9 7.2 31.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.881 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 33.5 m170 -79.81 -176.41 5.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.47 . . . . 72.33 110.933 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -117.55 146.07 43.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 73.24 110.917 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.9 m -136.17 -174.51 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 64.55 111.157 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -109.34 79.84 1.26 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.454 . . . . 63.32 111.069 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -70.23 140.5 52.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.22 -0.445 . . . . 25.4 111.08 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.59 153.42 27.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 75.54 110.967 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -158.91 107.75 1.91 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 72.24 110.823 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 62.21 110.863 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 C--O 1.231 0.086 0 CA-C-O 119.344 -0.36 . . . . 64.54 110.873 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.2 161.09 29.66 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.438 1.086 . . . . 55.42 108.334 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 1.1 mp -74.1 -47.95 32.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.057 -0.974 . . . . 61.04 110.943 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.15 -36.02 23.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 75.15 110.902 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 178' ' ' HIS . . . . . 0.664 ' NE2' HD22 ' A' ' 197' ' ' LEU . 49.4 m80 -93.97 104.5 16.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.132 -0.485 . . . . 63.33 110.888 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.62 -32.83 25.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 65.23 110.869 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -94.95 34.71 1.33 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 62.01 110.845 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.635 ' OE2' HD12 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -155.71 113.08 3.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 63.42 110.885 -179.898 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.17 153.28 36.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 74.04 110.943 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 183' ' ' VAL . . . . . 0.834 HG11 HD22 ' A' ' 193' ' ' LEU . 12.7 m -53.59 174.52 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 61.14 111.14 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 55.5 t-20 -132.83 -40.86 0.94 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 73.4 110.928 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.1 -170.12 2.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 72.14 110.9 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.58 ' CE2' HG22 ' A' ' 188' ' ' VAL . 10.9 t80 -119.61 123.75 44.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 75.25 110.939 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.44 108.49 14.11 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.489 1.118 . . . . 55.33 108.35 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 188' ' ' VAL . . . . . 0.58 HG22 ' CE2' ' A' ' 186' ' ' TYR . 65.7 t -73.81 -26.79 21.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.013 -0.994 . . . . 71.12 111.123 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 189' ' ' THR . . . . . 0.725 HG23 ' HB2' ' A' ' 208' ' ' GLN . 0.8 OUTLIER -61.63 -56.73 16.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.193 -0.458 . . . . 75.33 111.181 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -89.91 -12.45 38.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.197 -0.456 . . . . 55.21 110.866 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 5.5 t0 64.33 58.67 1.08 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.209 -0.451 . . . . 52.3 110.944 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -162.52 124.39 2.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 73.51 110.92 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 193' ' ' LEU . . . . . 0.834 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.81 149.33 6.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.174 -0.466 . . . . 73.31 110.896 -179.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -147.87 -178.87 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 55.23 111.192 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 20.4 p -125.7 -175.29 3.3 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.549 1.156 . . . . 44.13 108.308 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -73.15 -35.84 66.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.013 -0.994 . . . . 72.21 111.064 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.664 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.2 OUTLIER -64.67 -24.16 67.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.192 -0.458 . . . . 72.31 110.894 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 30.1 m -81.17 -34.87 32.09 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.558 1.161 . . . . 73.25 108.353 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 28.3 mtmt -76.89 -14.86 59.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.036 -0.983 . . . . 74.33 110.957 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 5.7 tp -105.35 -44.86 4.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 72.13 110.922 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 201' ' ' VAL . . . . . 0.578 HG21 HD23 ' A' ' 197' ' ' LEU . 47.2 t -89.73 -42.8 14.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.2 -0.455 . . . . 72.33 111.12 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -74.89 -142.33 0.84 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.79 -0.719 . . . . 54.41 112.48 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -129.08 23.95 5.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.855 0.359 . . . . 74.51 110.859 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -95.65 37.35 1.21 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 51.41 110.876 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 10.5 ptt-85 -94.31 -32.7 13.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 74.24 110.872 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -105.03 7.23 33.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 71.15 110.844 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 51.0 m170 -79.68 174.92 11.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 65.14 110.885 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . 0.725 ' HB2' HG23 ' A' ' 189' ' ' THR . 0.5 OUTLIER -99.23 144.46 28.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 63.02 110.961 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 34.0 m -146.21 -175.88 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.25 -0.432 . . . . 63.43 111.14 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 73.13 111.127 179.94 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 174' ' ' MET . . . . . 0.44 ' HE1' ' HG2' ' A' ' 179' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.072 0 CA-C-O 119.277 -0.392 . . . . 71.25 110.857 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.04 161.13 20.82 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.477 1.111 . . . . 70.4 108.3 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.23 -53.47 29.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.003 -0.999 . . . . 71.42 110.882 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.4 -36.58 22.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.445 . . . . 72.12 110.863 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -91.08 90.39 7.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 74.11 110.803 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . 0.44 ' HG2' ' HE1' ' A' ' 174' ' ' MET . 1.2 mt-10 -86.27 4.85 37.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 74.21 110.921 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -120.03 34.69 5.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.118 -0.492 . . . . 73.4 110.859 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.88 -169.93 3.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 75.33 110.868 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.55 125.72 26.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 75.01 110.934 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 183' ' ' VAL . . . . . 0.476 ' CG1' HD22 ' A' ' 193' ' ' LEU . 31.2 m -51.48 167.64 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 53.32 111.137 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -133.05 -51.19 0.89 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 74.12 110.864 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -148.87 -172.18 4.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 73.32 110.86 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -127.48 130.67 49.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.184 -0.462 . . . . 75.5 110.937 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.64 104.75 14.0 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.447 1.092 . . . . 63.44 108.313 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 43.1 t -73.26 -27.24 23.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 114.979 -1.009 . . . . 55.15 111.132 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.31 -55.41 24.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 71.32 111.145 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.05 -10.87 45.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 75.43 110.872 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 2.4 t70 64.45 59.25 1.0 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 55.43 110.887 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -161.86 127.08 3.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 62.32 110.917 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 193' ' ' LEU . . . . . 0.476 HD22 ' CG1' ' A' ' 183' ' ' VAL . 0.2 OUTLIER -51.72 152.26 2.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 74.33 110.922 -179.986 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 194' ' ' ILE . . . . . 0.609 HD11 HG11 ' A' ' 209' ' ' VAL . 1.0 OUTLIER -144.64 142.86 23.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.444 . . . . 55.13 111.157 179.815 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 19.6 p -104.41 -175.09 2.7 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.507 1.129 . . . . 64.23 108.331 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -68.73 -39.03 80.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.024 -0.989 . . . . 72.12 111.078 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.16 -18.45 64.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 65.44 110.924 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 5.7 m -80.97 -33.48 33.82 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.524 1.14 . . . . 61.23 108.306 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.33 -15.52 59.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.978 -1.01 . . . . 64.23 110.925 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 tp -105.3 -44.75 4.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 75.04 110.887 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 49.0 t -89.85 -42.49 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 71.34 111.14 179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -77.87 -146.59 2.79 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.762 -0.733 . . . . 55.31 112.471 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -134.24 24.25 3.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.852 0.358 . . . . 75.1 110.837 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . 0.518 ' CG ' HG21 ' A' ' 194' ' ' ILE . 89.6 m-70 -95.99 38.68 1.17 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 71.12 110.842 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 10.3 ttm-85 -94.18 -47.69 6.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 64.02 110.878 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.49 7.14 40.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.199 -0.455 . . . . 75.14 110.83 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -79.94 174.94 11.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 74.52 110.847 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.64 143.97 25.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 75.03 110.916 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 209' ' ' VAL . . . . . 0.609 HG11 HD11 ' A' ' 194' ' ' ILE . 26.9 m -150.71 -176.22 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 74.54 111.133 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 74.13 111.087 179.915 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 119.248 -0.406 . . . . 75.42 110.879 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -72.34 163.44 27.97 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.513 1.133 . . . . 74.32 108.285 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.63 -52.44 17.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.99 -1.005 . . . . 51.23 110.901 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -84.05 -37.15 22.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 73.52 110.941 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 178' ' ' HIS . . . . . 0.624 ' NE2' HD22 ' A' ' 197' ' ' LEU . 29.3 m80 -88.66 91.71 8.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 73.54 110.882 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -26.29 53.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.239 -0.437 . . . . 72.32 110.87 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -97.93 34.41 1.91 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.232 -0.44 . . . . 65.45 110.891 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.61 ' OE2' HD12 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -156.29 113.09 3.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 70.43 110.9 -179.849 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.3 149.83 40.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 65.44 110.933 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 183' ' ' VAL . . . . . 0.835 HG11 HD22 ' A' ' 193' ' ' LEU . 15.9 m -53.59 175.17 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.289 -0.414 . . . . 55.42 111.19 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -131.04 -40.05 1.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 72.11 110.847 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.15 -170.18 2.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 71.41 110.95 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.537 ' CE2' HG22 ' A' ' 188' ' ' VAL . 14.8 t80 -117.15 124.64 49.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.277 -0.419 . . . . 74.14 110.93 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -81.35 107.98 14.58 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.552 1.157 . . . . 73.13 108.258 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 188' ' ' VAL . . . . . 0.537 HG22 ' CE2' ' A' ' 186' ' ' TYR . 91.4 t -74.08 -28.67 23.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.024 -0.989 . . . . 73.43 111.085 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.86 -56.47 20.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 72.42 111.149 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.69 -12.36 39.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.242 -0.436 . . . . 63.24 110.916 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 6.2 t0 64.0 56.36 1.44 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 53.22 110.881 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -161.0 122.99 3.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.453 . . . . 74.14 110.931 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 193' ' ' LEU . . . . . 0.835 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -50.7 148.64 3.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.138 -0.483 . . . . 64.11 110.943 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -147.33 -178.87 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.252 -0.431 . . . . 72.25 111.153 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 18.6 p -125.23 -175.44 3.31 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.49 1.119 . . . . 62.34 108.323 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -74.29 -36.12 63.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.057 -0.974 . . . . 70.4 111.069 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.624 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.3 OUTLIER -60.67 -27.42 67.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 64.15 111.006 180.0 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 67.0 m -81.03 -35.11 32.29 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.447 1.092 . . . . 52.03 108.341 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -76.85 -14.96 59.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.998 -1.001 . . . . 74.43 110.911 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.5 tp -105.32 -44.93 4.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.182 -0.463 . . . . 34.12 110.926 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 45.0 t -89.67 -42.87 14.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 73.55 111.111 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.43 -142.93 1.04 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.742 -0.742 . . . . 72.34 112.453 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -129.7 24.79 5.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.84 0.352 . . . . 61.21 110.878 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -92.36 43.99 1.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 74.02 110.882 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.65 -47.08 7.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.45 . . . . 73.22 110.868 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -88.15 6.95 34.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 75.14 110.848 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 41.7 m170 -81.94 120.33 25.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 74.33 110.87 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.96 143.9 50.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.218 -0.446 . . . . 63.22 110.933 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.8 m -140.92 -173.57 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 72.42 111.16 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 72.33 111.122 179.892 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 N--CA 1.458 -0.062 0 CA-C-O 119.24 -0.409 . . . . 61.31 110.93 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -59.87 165.19 3.32 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.505 1.128 . . . . 54.42 108.306 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.28 -52.82 12.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.003 -0.999 . . . . 75.14 110.824 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -84.12 -37.39 22.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 72.35 110.817 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 27.5 m80 -87.48 120.09 28.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 74.23 110.845 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -98.66 -31.65 11.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 64.22 110.892 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -95.88 34.59 1.5 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.486 . . . . 63.01 110.883 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.515 ' CD ' HD13 ' A' ' 197' ' ' LEU . 1.7 mp0 -153.48 90.3 1.4 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 73.02 110.935 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -57.33 147.32 26.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.446 . . . . 73.32 110.92 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 183' ' ' VAL . . . . . 0.752 HG11 HD22 ' A' ' 193' ' ' LEU . 21.8 m -51.86 171.11 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.273 -0.421 . . . . 63.3 111.172 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -132.45 -39.39 1.02 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.213 -0.449 . . . . 50.32 110.897 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.07 -169.95 1.99 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 72.32 110.88 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.679 ' CE2' HG22 ' A' ' 188' ' ' VAL . 9.0 t80 -123.32 124.88 43.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.261 -0.427 . . . . 64.32 110.921 -179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 187' ' ' CYS . . . . . 0.456 ' HA ' HG12 ' A' ' 209' ' ' VAL . 0.1 OUTLIER -83.99 110.22 18.26 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.482 1.114 . . . . 62.33 108.366 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 188' ' ' VAL . . . . . 0.679 HG22 ' CE2' ' A' ' 186' ' ' TYR . 62.0 t -75.3 -40.71 43.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 114.95 -1.023 . . . . 75.02 111.081 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 189' ' ' THR . . . . . 0.4 HG23 ' N ' ' A' ' 190' ' ' ASP . 3.4 t -51.68 -44.61 63.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 64.13 111.117 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . 0.4 ' N ' HG23 ' A' ' 189' ' ' THR . 11.7 m-20 -97.49 -16.28 20.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.45 . . . . 64.21 110.774 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 9.4 t0 63.88 58.08 1.27 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.245 -0.434 . . . . 72.33 110.869 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -163.5 121.19 1.87 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.22 -0.446 . . . . 71.41 110.943 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 193' ' ' LEU . . . . . 0.752 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -50.86 148.77 3.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.256 -0.429 . . . . 74.3 110.861 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.1 pp -144.55 -179.49 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 65.34 111.132 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.9 p -128.02 -175.56 3.53 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.47 1.106 . . . . 74.32 108.368 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.57 -34.02 67.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.027 -0.988 . . . . 62.32 111.027 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.515 HD13 ' CD ' ' A' ' 181' ' ' GLU . 0.5 OUTLIER -70.18 -20.54 63.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 71.52 110.989 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 4.5 m -81.18 -35.52 31.31 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.538 1.149 . . . . 42.12 108.29 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -76.83 -14.88 59.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.07 -0.968 . . . . 75.34 110.866 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 tp -105.23 -44.92 4.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.247 -0.433 . . . . 72.22 110.93 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 43.3 t -89.65 -43.01 14.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.22 -0.445 . . . . 72.41 111.143 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -74.48 -142.07 0.75 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.742 -0.742 . . . . 73.11 112.429 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 11.3 mtp180 -128.87 24.09 5.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.875 0.369 . . . . 64.51 110.883 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -94.59 38.27 1.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 73.25 110.901 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -94.09 -34.18 13.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 65.41 110.865 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -104.99 7.3 34.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 72.14 110.837 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -79.72 -175.88 5.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.834 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.09 143.86 45.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.456 . . . . 74.24 110.958 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 209' ' ' VAL . . . . . 0.456 HG12 ' HA ' ' A' ' 187' ' ' CYS . 31.4 m -143.12 -176.39 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.233 -0.44 . . . . 74.44 111.169 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 71.53 111.071 179.813 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.526 0.049 0 CA-C-O 119.239 -0.41 . . . . 74.14 110.882 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -93.86 163.18 13.61 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.521 1.138 . . . . 71.12 108.318 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.97 -53.01 22.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.031 -0.986 . . . . 73.21 110.886 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.36 -36.81 22.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 75.34 110.891 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 178' ' ' HIS . . . . . 0.505 ' NE2' HD22 ' A' ' 197' ' ' LEU . 48.3 m80 -89.29 88.34 7.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.133 -0.485 . . . . 74.32 110.882 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.31 -23.99 46.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 74.45 110.918 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -95.4 34.57 1.43 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.097 -0.501 . . . . 74.24 110.888 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -152.3 172.83 15.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 52.25 110.884 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.11 139.11 53.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.097 -0.502 . . . . 63.41 110.834 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 183' ' ' VAL . . . . . 0.843 HG11 HD22 ' A' ' 193' ' ' LEU . 8.1 m -50.9 169.3 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 71.33 111.15 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -130.39 -43.09 1.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 74.0 110.857 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -154.46 -172.81 4.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 74.33 110.853 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -124.07 127.76 48.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.28 -0.418 . . . . 75.23 110.905 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -82.07 107.21 14.59 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.513 1.133 . . . . 52.31 108.3 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 40.2 t -73.71 -26.76 22.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 114.994 -1.003 . . . . 72.43 111.125 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 189' ' ' THR . . . . . 0.516 HG23 ' HB2' ' A' ' 208' ' ' GLN . 0.0 OUTLIER -62.1 -56.16 21.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.226 -0.443 . . . . 73.34 111.131 -179.875 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.32 -12.39 37.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 71.55 110.869 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 1.9 t70 64.27 58.61 1.1 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 65.35 110.874 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -159.22 118.35 2.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 72.05 110.85 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 193' ' ' LEU . . . . . 0.843 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -50.74 148.83 3.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 45.32 110.856 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -147.41 -179.87 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.452 . . . . 73.04 111.144 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 23.3 p -123.46 -175.68 3.26 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.445 1.091 . . . . 45.4 108.339 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -71.82 -34.3 69.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.992 -1.004 . . . . 64.52 111.104 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.505 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.2 OUTLIER -69.5 -20.5 63.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 62.31 110.928 179.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 8.1 m -80.87 -35.99 31.91 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.477 1.11 . . . . 61.14 108.312 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 33.4 mtmt -77.17 -14.35 59.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.004 -0.998 . . . . 64.03 110.921 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.1 tp -105.14 -44.61 4.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.239 -0.437 . . . . 74.04 110.962 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 201' ' ' VAL . . . . . 0.446 HG21 ' CD2' ' A' ' 197' ' ' LEU . 44.1 t -89.68 -42.86 14.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.187 -0.46 . . . . 74.04 111.096 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.79 -140.67 0.91 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.72 -0.752 . . . . 74.54 112.47 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 80.0 mtm180 -132.51 22.78 4.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.853 0.359 . . . . 75.2 110.896 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -96.95 38.64 1.22 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.179 -0.464 . . . . 73.23 110.832 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 4.3 ttt85 -94.25 -43.95 8.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 65.13 110.839 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -93.71 7.13 45.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 73.35 110.812 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.8 m170 -79.78 174.84 11.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 73.15 110.852 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . 0.516 ' HB2' HG23 ' A' ' 189' ' ' THR . 0.5 OUTLIER -93.41 143.79 25.95 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.193 -0.458 . . . . 74.52 110.881 -179.926 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 29.9 m -150.32 -175.03 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 45.32 111.167 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.211 -0.45 . . . . 55.32 111.073 179.833 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 174' ' ' MET . . . . . 0.437 ' HA ' HG13 ' A' ' 183' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.526 0.029 0 CA-C-O 119.311 -0.376 . . . . 63.41 110.826 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -55.02 163.28 1.07 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.544 1.153 . . . . 74.12 108.34 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.82 -54.69 10.65 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.048 -0.978 . . . . 73.42 110.917 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -84.22 -36.88 22.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 63.14 110.941 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 10.0 m170 -88.93 64.2 7.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 62.32 110.833 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -24.52 52.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 52.14 110.896 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -95.54 34.71 1.43 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 65.34 110.775 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.499 ' CD ' HD13 ' A' ' 197' ' ' LEU . 0.3 OUTLIER -154.71 103.48 2.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 74.41 110.96 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.5 151.98 9.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 71.24 110.94 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 183' ' ' VAL . . . . . 0.722 HG11 HD22 ' A' ' 193' ' ' LEU . 27.6 m -69.67 172.15 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.457 . . . . 63.24 111.073 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -129.46 -45.55 1.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 71.01 110.892 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.11 -170.1 3.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 72.2 110.895 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -123.59 129.25 50.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 74.24 110.902 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -85.78 106.4 17.0 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.548 1.155 . . . . 63.43 108.264 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 99.7 t -75.01 -39.89 44.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 114.948 -1.024 . . . . 70.4 111.127 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 1.2 t -51.34 -39.18 56.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 63.01 111.107 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -106.75 -9.5 16.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.296 -0.411 . . . . 63.2 110.841 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 5.7 t70 61.43 55.2 2.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 75.54 110.868 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.65 127.5 6.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 75.24 110.876 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 193' ' ' LEU . . . . . 0.722 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -50.89 152.36 2.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.214 -0.448 . . . . 74.4 110.906 179.963 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -146.29 143.25 21.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.193 -0.458 . . . . 73.3 111.124 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 14.8 p -101.09 -175.4 2.86 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.554 1.159 . . . . 72.21 108.343 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -71.3 -41.28 70.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.062 -0.972 . . . . 72.11 111.11 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.499 HD13 ' CD ' ' A' ' 181' ' ' GLU . 0.4 OUTLIER -58.23 -25.35 61.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.288 -0.414 . . . . 73.04 110.919 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 62.9 m -81.22 -33.83 32.6 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.449 1.093 . . . . 64.24 108.301 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.38 -16.07 59.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.045 -0.979 . . . . 72.3 110.941 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.7 tp -105.68 -45.67 4.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 60.44 110.897 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 42.1 t -89.66 -43.21 14.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 73.51 111.192 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -72.86 -149.3 1.04 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.745 -0.74 . . . . 64.05 112.509 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.21 22.5 4.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.818 0.342 . . . . 63.2 110.843 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -90.04 47.94 1.51 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 64.3 110.901 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -94.07 -49.41 5.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.91 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -82.12 0.48 40.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.466 . . . . 75.24 110.864 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 38.6 m170 -79.85 120.9 24.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.252 -0.431 . . . . 72.22 110.821 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.53 153.9 18.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 73.05 110.931 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.5 m -147.7 -172.99 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 73.43 111.136 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 52.45 111.103 179.95 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.527 0.073 0 CA-C-O 119.285 -0.388 . . . . 75.31 110.811 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -77.01 162.0 27.89 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.566 1.166 . . . . 53.05 108.272 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.7 mp -71.62 -50.65 28.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.964 -1.017 . . . . 74.54 110.97 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -84.14 -38.74 20.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.183 -0.462 . . . . 72.41 110.894 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 178' ' ' HIS . . . . . 0.627 ' NE2' HD22 ' A' ' 197' ' ' LEU . 40.6 m80 -88.49 110.85 21.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 73.21 110.9 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -90.4 -32.99 16.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 61.1 110.915 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -95.23 34.78 1.37 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.074 -0.512 . . . . 74.1 110.862 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.608 ' HG3' HD12 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -154.32 106.54 2.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 75.12 110.881 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 8.2 mtpp -72.48 149.4 44.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.505 . . . . 70.24 110.882 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 183' ' ' VAL . . . . . 0.858 HG11 HD22 ' A' ' 193' ' ' LEU . 12.6 m -51.24 169.51 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.243 -0.435 . . . . 42.41 111.135 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -127.74 -38.76 1.85 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 72.31 110.909 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.3 -170.04 1.97 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 62.14 110.836 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -118.46 127.98 54.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 74.44 110.881 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -82.13 108.47 15.63 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.561 1.163 . . . . 72.21 108.248 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 61.6 t -73.81 -27.39 22.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 114.994 -1.003 . . . . 65.3 111.142 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.32 -55.78 24.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 52.44 111.113 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.58 -11.27 40.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.436 . . . . 63.13 110.842 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 18.4 t0 63.63 54.15 1.92 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 61.51 110.803 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -157.73 126.07 5.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.246 -0.434 . . . . 54.1 110.881 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 193' ' ' LEU . . . . . 0.858 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.13 150.91 4.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 70.44 110.924 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.7 pp -149.88 -179.4 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 74.43 111.107 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 17.5 p -126.78 -175.63 3.46 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.431 1.082 . . . . 64.43 108.294 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -73.12 -38.24 66.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.064 -0.971 . . . . 63.33 111.145 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.627 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.3 OUTLIER -59.03 -27.43 65.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 72.22 110.969 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 67.6 m -81.01 -34.07 33.18 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.514 1.134 . . . . 71.01 108.3 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -76.22 -15.42 60.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.977 -1.01 . . . . 75.4 110.911 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.73 -45.54 4.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 71.1 110.92 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 201' ' ' VAL . . . . . 0.566 ' CG2' HD23 ' A' ' 197' ' ' LEU . 53.5 t -89.64 -43.0 14.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.158 -0.474 . . . . 42.33 111.143 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.58 -146.55 0.93 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.667 -0.778 . . . . 64.44 112.469 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 53.2 ttt180 -128.12 24.68 5.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.771 0.32 . . . . 75.23 110.884 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 62.2 m-70 -94.12 39.91 1.08 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 74.21 110.856 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 7.7 ttm-85 -87.34 -45.66 10.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 74.42 110.856 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -89.57 5.53 45.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.178 -0.465 . . . . 72.42 110.854 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 41.5 m170 -81.04 120.17 24.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.218 -0.446 . . . . 64.3 110.882 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.94 143.89 50.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 72.34 110.875 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 19.0 m -140.37 -173.58 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 73.04 111.098 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 73.5 111.117 179.884 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 119.227 -0.416 . . . . 75.31 110.923 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -75.98 161.19 29.12 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.505 1.128 . . . . 51.52 108.307 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 10.6 mp -70.63 -51.74 25.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.027 -0.988 . . . . 70.32 110.989 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -84.03 -35.23 23.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.458 . . . . 64.33 110.899 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 22.6 m80 -94.64 93.74 7.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.106 -0.497 . . . . 70.13 110.859 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.03 -23.81 38.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.459 . . . . 74.01 110.857 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -95.44 34.62 1.43 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 75.04 110.872 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.75 112.98 1.94 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 50.02 110.894 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 14.4 pttt -72.11 146.08 47.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 71.05 110.882 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 183' ' ' VAL . . . . . 0.813 HG11 HD22 ' A' ' 193' ' ' LEU . 31.6 m -51.94 171.25 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.197 -0.456 . . . . 63.52 111.147 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -132.33 -38.72 1.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.169 -0.469 . . . . 63.22 110.89 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -158.61 -170.1 2.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 55.25 110.884 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -129.0 128.11 43.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 74.3 110.878 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -83.64 109.78 17.73 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.431 1.082 . . . . 74.43 108.294 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 39.6 t -75.27 -42.19 43.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 114.961 -1.018 . . . . 75.43 111.068 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 189' ' ' THR . . . . . 0.403 HG23 ' N ' ' A' ' 190' ' ' ASP . 3.5 t -51.69 -44.14 63.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 74.33 111.113 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . 0.403 ' N ' HG23 ' A' ' 189' ' ' THR . 9.0 m-20 -97.5 -14.95 20.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 73.14 110.868 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.85 56.54 1.86 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 63.34 110.847 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -158.77 120.36 3.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.465 . . . . 75.44 110.927 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 193' ' ' LEU . . . . . 0.813 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.25 148.91 5.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 72.24 110.875 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -144.88 -179.77 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.19 -0.459 . . . . 61.44 111.072 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.1 p -126.82 -175.52 3.43 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.592 1.183 . . . . 75.24 108.34 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.87 -32.68 65.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.002 -0.999 . . . . 45.35 111.077 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.86 -21.09 62.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 71.14 110.955 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 6.8 m -81.17 -35.35 31.55 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.485 1.116 . . . . 64.12 108.333 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? -76.96 -14.69 59.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.987 -1.006 . . . . 71.24 110.945 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.2 tp -105.38 -44.82 4.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 73.32 110.878 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 44.1 t -89.71 -42.91 14.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 61.44 111.131 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.54 -142.45 1.02 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.78 -0.724 . . . . 60.51 112.467 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 5.2 mtt85 -132.38 23.27 4.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.879 0.371 . . . . 71.33 110.881 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -94.55 38.36 1.11 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.162 -0.472 . . . . 70.3 110.825 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -94.22 -42.46 8.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.246 -0.433 . . . . 65.34 110.809 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -94.85 7.19 46.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.222 -0.444 . . . . 50.2 110.874 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.3 m170 -79.84 176.13 10.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 63.42 110.857 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.91 143.94 26.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 74.13 110.889 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 32.8 m -150.24 -175.61 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 73.52 111.198 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 72.1 111.072 179.878 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.141 0 CA-C-O 119.227 -0.416 . . . . 71.23 110.937 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -81.36 160.96 23.98 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.481 1.113 . . . . 74.45 108.269 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.0 mp -76.43 -45.96 29.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.927 -1.033 . . . . 63.5 110.944 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -84.4 -34.79 23.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 73.31 110.854 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 178' ' ' HIS . . . . . 0.747 ' CD2' HD22 ' A' ' 197' ' ' LEU . 37.8 m80 -99.44 78.49 2.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.137 -0.483 . . . . 75.22 110.878 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -62.74 -31.1 71.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.235 -0.438 . . . . 75.31 110.919 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -94.31 34.72 1.25 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.171 -0.468 . . . . 63.44 110.806 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.69 112.83 3.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.279 -0.418 . . . . 63.2 110.916 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 18.3 mtpt -72.51 144.62 47.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.185 -0.461 . . . . 61.51 110.845 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 183' ' ' VAL . . . . . 0.796 HG11 HD22 ' A' ' 193' ' ' LEU . 29.3 m -51.51 170.56 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.19 -0.459 . . . . 74.44 111.18 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -131.85 -38.71 1.12 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.449 . . . . 63.04 110.912 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.69 -170.03 2.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.197 -0.456 . . . . 74.32 110.868 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -128.54 127.98 43.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 75.14 110.949 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -83.72 109.84 17.82 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.45 1.094 . . . . 70.51 108.265 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 22.0 t -75.23 -42.11 44.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 114.939 -1.028 . . . . 71.35 111.132 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 189' ' ' THR . . . . . 0.402 HG23 ' N ' ' A' ' 190' ' ' ASP . 3.5 t -51.69 -44.07 63.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 72.42 111.154 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . 0.402 ' N ' HG23 ' A' ' 189' ' ' THR . 9.4 m-20 -97.56 -15.03 20.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.157 -0.474 . . . . 62.44 110.843 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 62.85 56.54 1.86 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.189 -0.46 . . . . 72.22 110.913 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -159.04 120.25 3.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 74.31 110.917 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 193' ' ' LEU . . . . . 0.796 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.17 148.87 5.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 75.51 110.905 -179.961 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -145.37 -179.63 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 75.02 111.099 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 25.6 p -126.74 -175.55 3.44 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.544 1.153 . . . . 72.21 108.317 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.81 -33.03 65.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.97 -1.014 . . . . 75.32 111.131 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.747 HD22 ' CD2' ' A' ' 178' ' ' HIS . 0.1 OUTLIER -70.43 -20.98 62.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.45 . . . . 63.44 110.947 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 7.7 m -81.26 -35.44 31.16 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.52 1.138 . . . . 74.22 108.288 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 26.0 mtmt -77.02 -14.77 59.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.99 -1.004 . . . . 75.33 110.886 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.3 tp -105.18 -44.7 4.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.232 -0.44 . . . . 71.04 110.938 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 201' ' ' VAL . . . . . 0.636 HG21 HD23 ' A' ' 197' ' ' LEU . 44.3 t -89.71 -42.81 14.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 72.12 111.075 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.96 -141.64 1.06 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.733 -0.746 . . . . 44.1 112.455 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 58.2 mtp180 -132.65 23.62 4.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.806 0.336 . . . . 73.25 110.819 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -94.78 37.95 1.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.235 -0.439 . . . . 64.41 110.894 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -94.14 -42.06 9.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.25 -0.432 . . . . 75.24 110.865 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 13.4 p-10 -95.34 7.14 47.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 64.12 110.895 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -79.79 177.16 9.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 74.2 110.913 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -96.99 143.94 27.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 54.23 110.932 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 34.5 m -150.4 -175.99 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 63.43 111.128 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 71.34 111.083 179.993 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 119.319 -0.372 . . . . 74.21 110.833 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.39 160.93 25.21 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.445 1.091 . . . . 72.31 108.283 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 2.5 mp -66.3 -55.29 16.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.984 -1.007 . . . . 73.23 110.929 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -84.35 -33.73 23.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.249 -0.432 . . . . 64.1 110.895 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -94.6 75.01 3.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 74.1 110.832 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -25.42 67.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 51.14 110.895 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.55 34.6 1.45 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.107 -0.497 . . . . 73.24 110.86 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -130.47 -172.61 2.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 61.35 110.916 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.9 mttp -136.95 120.88 17.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.226 -0.443 . . . . 65.22 110.896 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 183' ' ' VAL . . . . . . . . . . . . . 19.8 m -51.31 165.03 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 72.33 111.183 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -134.05 -50.87 0.83 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 64.13 110.844 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . 0.425 ' O ' HD23 ' A' ' 193' ' ' LEU . 0.0 OUTLIER -154.88 -170.1 3.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.187 -0.46 . . . . 55.34 110.932 179.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -127.12 129.56 48.16 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.323 -0.398 . . . . 70.11 110.951 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.33 105.31 14.18 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.477 1.111 . . . . 73.42 108.24 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 58.8 t -73.27 -26.16 22.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 114.966 -1.015 . . . . 74.45 111.12 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.6 -55.79 20.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 63.31 111.198 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -89.76 -10.32 46.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 40.44 110.866 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 6.1 t70 64.15 58.25 1.17 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.177 -0.465 . . . . 63.0 110.862 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -160.22 127.13 4.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 52.51 110.893 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 193' ' ' LEU . . . . . 0.425 HD23 ' O ' ' A' ' 185' ' ' MET . 0.2 OUTLIER -51.35 152.64 2.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 40.24 110.962 179.985 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 194' ' ' ILE . . . . . 0.557 HD11 HG11 ' A' ' 209' ' ' VAL . 1.0 OUTLIER -144.84 142.77 22.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 73.33 111.087 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 14.8 p -107.12 -174.32 2.51 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.475 1.109 . . . . 72.23 108.31 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.37 -44.45 78.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.032 -0.985 . . . . 72.41 111.088 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -20.35 62.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.449 . . . . 75.04 110.914 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 24.8 m -80.82 -32.55 35.16 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.497 1.123 . . . . 75.24 108.325 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 4.5 mtpm? -77.34 -15.85 59.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.027 -0.988 . . . . 73.13 110.9 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.6 tp -105.38 -44.85 4.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.463 . . . . 61.03 110.912 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 61.5 t -89.82 -42.57 14.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.215 -0.448 . . . . 73.2 111.118 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -78.25 -148.79 3.89 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.739 -0.743 . . . . 15.33 112.478 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 8.3 ttm180 -134.25 24.75 3.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.799 0.333 . . . . 74.03 110.841 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . 0.506 ' CG ' HG21 ' A' ' 194' ' ' ILE . 92.5 m-70 -95.47 38.84 1.14 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 74.01 110.858 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 3.6 ttp85 -94.22 -48.0 6.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.244 -0.434 . . . . 70.34 110.842 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -90.39 7.36 39.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 64.01 110.867 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 31.5 m170 -79.94 175.01 11.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 74.54 110.896 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 52.0 mm-40 -95.03 147.55 23.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.29 -0.414 . . . . 70.43 110.952 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 209' ' ' VAL . . . . . 0.557 HG11 HD11 ' A' ' 194' ' ' ILE . 35.9 m -150.33 -176.06 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 53.14 111.128 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.46 . . . . 64.41 111.132 179.869 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.086 0 CA-C-O 119.242 -0.408 . . . . 75.11 110.944 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -54.9 161.26 1.66 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.494 1.121 . . . . 45.52 108.301 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.2 mp -68.63 -54.77 14.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.969 -1.014 . . . . 71.31 110.905 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -83.98 -35.43 23.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.167 -0.469 . . . . 72.32 110.926 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 16.3 m80 -93.41 62.52 3.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.122 -0.49 . . . . 72.34 110.854 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -57.82 -23.6 53.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 72.33 110.947 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.45 34.6 1.43 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.122 -0.49 . . . . 64.54 110.809 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -151.47 89.29 1.48 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 73.42 110.872 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.97 121.0 5.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.103 -0.499 . . . . 71.25 110.916 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 183' ' ' VAL . . . . . 0.838 HG11 HD22 ' A' ' 193' ' ' LEU . 16.7 m -51.74 163.79 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.445 . . . . 73.0 111.129 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -117.41 -36.77 3.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.15 110.849 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -162.58 -168.54 1.85 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 71.24 110.813 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.718 ' CZ ' HG22 ' A' ' 188' ' ' VAL . 0.2 OUTLIER -132.52 138.64 47.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 65.12 110.905 -179.929 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -74.59 116.43 15.27 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.539 1.149 . . . . 62.13 108.245 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 188' ' ' VAL . . . . . 0.718 HG22 ' CZ ' ' A' ' 186' ' ' TYR . 68.7 t -74.74 -38.47 44.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 114.972 -1.013 . . . . 63.21 111.083 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.98 -53.64 55.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 74.33 111.173 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -86.14 -10.36 54.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 71.22 110.859 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 34.2 t70 57.31 50.38 11.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 73.25 110.815 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -148.61 127.33 12.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 53.3 110.913 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 193' ' ' LEU . . . . . 0.838 HD22 HG11 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -51.17 150.78 3.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.224 -0.444 . . . . 74.55 110.878 -179.958 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 194' ' ' ILE . . . . . 0.439 HG23 ' O ' ' A' ' 193' ' ' LEU . 1.0 OUTLIER -155.67 142.82 11.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.197 -0.456 . . . . 65.24 111.127 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 25.5 p -97.79 -175.02 3.05 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.488 1.118 . . . . 40.21 108.279 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.2 -33.73 67.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.934 -1.03 . . . . 63.51 111.079 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.22 -24.75 65.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.261 -0.427 . . . . 73.1 110.904 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 34.5 m -80.95 -31.69 34.82 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.499 1.124 . . . . 74.21 108.291 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 41.4 mtpt -77.16 -16.59 59.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.981 -1.009 . . . . 71.34 110.971 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.3 tp -105.48 -45.22 4.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.193 -0.458 . . . . 72.43 110.929 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 61.9 t -89.87 -42.69 14.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.451 . . . . 72.41 111.117 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -72.35 -147.37 0.71 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.706 -0.759 . . . . 70.25 112.484 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.0 21.74 6.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.838 0.352 . . . . 74.44 110.886 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -95.97 39.69 1.14 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.111 -0.495 . . . . 74.02 110.93 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -94.18 -40.89 9.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.237 -0.438 . . . . 74.23 110.901 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.37 7.15 46.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 60.13 110.792 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.8 m170 -83.19 -175.26 5.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.262 -0.426 . . . . 72.11 110.877 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -117.01 147.22 42.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 75.21 110.883 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 17.9 m -139.71 -173.21 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.452 . . . . 74.44 111.15 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 72.25 111.098 179.895 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.526 0.028 0 CA-C-O 119.307 -0.377 . . . . 62.13 110.829 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.3 164.17 1.01 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.521 1.138 . . . . 73.41 108.33 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.4 mp -77.02 -48.03 19.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.98 -1.009 . . . . 64.11 110.918 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -84.17 -43.27 15.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 72.21 110.858 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 178' ' ' HIS . . . . . 0.484 ' CD2' HD13 ' A' ' 197' ' ' LEU . 20.7 m80 -89.77 62.11 5.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 75.21 110.869 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -52.24 -29.77 24.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.177 -0.465 . . . . 42.01 110.912 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -93.91 35.01 1.17 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 62.32 110.913 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.697 ' HG3' HD12 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -151.77 96.57 2.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 73.12 110.872 -179.851 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.48 126.38 27.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 73.1 110.902 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 183' ' ' VAL . . . . . 0.842 HG11 HD22 ' A' ' 193' ' ' LEU . 16.8 m -51.77 163.34 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.434 . . . . 74.43 111.102 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -118.96 -37.41 3.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 71.11 110.878 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.21 -168.45 2.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 73.15 110.831 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.748 ' CZ ' HG22 ' A' ' 188' ' ' VAL . 0.4 OUTLIER -132.71 138.69 47.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 72.21 110.947 -179.874 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.65 113.75 10.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.575 1.172 . . . . 64.2 108.359 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 188' ' ' VAL . . . . . 0.748 HG22 ' CZ ' ' A' ' 186' ' ' TYR . 60.5 t -74.21 -28.67 23.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.003 -0.998 . . . . 72.53 111.107 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.73 -56.34 16.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.453 . . . . 43.45 111.141 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.36 -4.59 55.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.246 -0.434 . . . . 72.41 110.843 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 6.2 t70 57.05 50.64 11.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 73.03 110.862 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.52 127.41 17.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 72.24 110.929 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 193' ' ' LEU . . . . . 0.842 HD22 HG11 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -51.64 150.67 3.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.162 -0.472 . . . . 72.21 110.919 -179.981 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 194' ' ' ILE . . . . . 0.462 HG23 ' O ' ' A' ' 193' ' ' LEU . 1.0 OUTLIER -156.45 142.57 10.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 70.44 111.163 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 20.8 p -97.47 -175.1 3.1 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.434 1.084 . . . . 71.5 108.31 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.02 -35.9 69.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.971 -1.013 . . . . 60.4 111.081 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.697 HD12 ' HG3' ' A' ' 181' ' ' GLU . 0.2 OUTLIER -64.98 -24.71 67.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 61.12 110.883 -179.983 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 37.0 m -81.08 -32.39 33.97 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.422 1.076 . . . . 52.23 108.27 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 30.9 mtmt -76.45 -16.53 59.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.99 -1.005 . . . . 73.42 110.842 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.3 tp -105.74 -45.51 4.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 61.13 110.939 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 201' ' ' VAL . . . . . 0.627 ' CG2' HD23 ' A' ' 197' ' ' LEU . 53.0 t -89.73 -42.93 14.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.16 -0.473 . . . . 74.41 111.197 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -71.79 -149.2 0.76 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.743 -0.742 . . . . 53.45 112.462 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.52 20.7 6.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.808 0.337 . . . . 74.24 110.874 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -96.71 39.38 1.17 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 74.33 110.907 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.08 -47.94 6.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 41.24 110.882 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.76 2.03 39.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.223 -0.444 . . . . 75.32 110.891 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 36.3 m170 -79.98 -176.46 5.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 73.42 110.876 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.09 144.61 42.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.196 -0.456 . . . . 64.02 110.884 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.9 m -135.57 -175.23 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.205 -0.452 . . . . 72.44 111.124 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.097 -0.501 . . . . 75.02 111.038 179.898 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.085 0 CA-C-O 119.278 -0.392 . . . . 51.21 110.862 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -61.75 162.01 9.3 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.496 1.122 . . . . 60.33 108.271 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 3.9 mp -68.25 -53.1 26.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.98 -1.009 . . . . 72.33 110.94 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -84.27 -35.39 23.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 61.23 110.879 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 178' ' ' HIS . . . . . 0.522 ' NE2' HD22 ' A' ' 197' ' ' LEU . 32.4 m80 -91.98 71.03 5.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 70.13 110.884 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -24.36 67.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.203 -0.453 . . . . 71.05 110.914 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -95.44 34.73 1.41 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.481 . . . . 74.55 110.77 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.521 ' OE1' HD13 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -140.1 -169.3 2.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 74.35 110.892 -179.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 9.7 tttt -140.71 127.61 20.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.485 . . . . 72.25 110.855 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 183' ' ' VAL . . . . . 0.787 HG11 HD22 ' A' ' 193' ' ' LEU . 3.3 m -50.61 167.81 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 70.0 111.081 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 39.6 t-20 -127.82 -38.08 1.89 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 73.43 110.856 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 1.2 mmt -164.17 -171.63 2.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 71.32 110.863 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.401 ' O ' HG12 ' A' ' 209' ' ' VAL . 51.3 t80 -117.07 126.93 53.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.216 -0.447 . . . . 71.21 110.954 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -83.43 107.06 15.68 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.45 1.094 . . . . 73.24 108.281 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 60.4 t -75.49 -41.27 42.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.011 -0.995 . . . . 64.13 111.1 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 189' ' ' THR . . . . . 0.544 HG23 ' OD2' ' A' ' 190' ' ' ASP . 1.2 t -50.49 -34.76 26.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.476 . . . . 71.34 111.079 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . 0.544 ' OD2' HG23 ' A' ' 189' ' ' THR . 1.1 m-20 -111.73 -9.44 14.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.266 -0.424 . . . . 54.52 110.827 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 9.2 t0 60.23 55.18 3.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 72.23 110.935 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -158.37 125.99 5.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.126 -0.488 . . . . 73.43 110.942 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 193' ' ' LEU . . . . . 0.787 HD22 HG11 ' A' ' 183' ' ' VAL . 0.1 OUTLIER -57.1 149.18 19.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.457 . . . . 72.35 110.904 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -150.32 -179.28 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 63.53 111.119 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 27.6 p -123.51 -175.51 3.22 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.509 1.131 . . . . 64.11 108.225 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -73.29 -32.28 64.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.983 -1.008 . . . . 61.11 111.06 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.522 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.3 OUTLIER -65.64 -25.5 67.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 74.32 110.951 -179.991 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 57.8 m -81.03 -35.45 31.86 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 124.568 1.168 . . . . 72.32 108.311 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 4.0 mtmt -76.91 -14.76 59.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.976 -1.011 . . . . 70.44 110.869 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.8 tp -105.38 -45.0 4.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.266 -0.425 . . . . 74.13 110.903 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 43.6 t -89.64 -43.0 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 62.21 111.122 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.94 -142.28 0.67 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.715 -0.755 . . . . 70.43 112.478 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -128.26 23.17 6.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.766 0.317 . . . . 72.44 110.896 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 -97.86 39.56 1.21 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.162 -0.472 . . . . 75.41 110.898 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -84.48 -40.51 17.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 71.2 110.859 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -97.95 7.05 46.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 65.3 110.905 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 207' ' ' HIS . . . . . 0.431 ' CG ' HG21 ' A' ' 189' ' ' THR . 39.3 m170 -80.5 120.48 24.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 74.14 110.813 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -59.64 163.66 4.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 73.03 110.913 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 209' ' ' VAL . . . . . 0.401 HG12 ' O ' ' A' ' 186' ' ' TYR . 14.0 m -149.11 -176.32 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 73.01 111.137 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.2 -0.455 . . . . 65.1 111.138 179.798 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 119.221 -0.418 . . . . 74.13 110.888 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.32 161.59 16.28 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.499 1.124 . . . . 73.0 108.31 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.76 -53.26 34.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.008 -0.996 . . . . 75.31 110.946 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -84.62 -36.35 22.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 71.45 110.869 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 34.0 m80 -91.47 88.94 7.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 64.32 110.776 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -78.5 -25.46 45.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 63.43 110.86 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -95.5 34.58 1.44 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 74.5 110.896 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -141.3 179.57 6.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 75.32 110.908 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.14 128.34 41.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 73.34 110.88 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 183' ' ' VAL . . . . . 0.794 HG11 HD22 ' A' ' 193' ' ' LEU . 22.8 m -50.81 168.0 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.157 -0.474 . . . . 63.12 111.165 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -127.6 -38.49 1.9 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.258 -0.428 . . . . 63.42 110.893 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -164.52 -170.15 1.96 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 62.34 110.831 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -120.11 127.4 52.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 72.15 110.956 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -80.67 108.05 13.99 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.446 1.091 . . . . 53.34 108.268 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 53.1 t -73.8 -28.49 24.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 114.955 -1.02 . . . . 63.34 111.191 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -55.6 28.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.133 -0.485 . . . . 73.11 111.191 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.5 -11.31 40.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 52.51 110.84 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 4.8 t70 63.51 55.05 1.82 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 75.43 110.889 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -157.39 125.12 5.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 72.52 110.88 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 193' ' ' LEU . . . . . 0.794 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.86 148.87 6.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.24 -0.436 . . . . 65.35 110.864 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.2 pp -147.24 -179.88 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 51.5 111.133 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 22.1 p -126.97 -175.67 3.49 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.465 1.103 . . . . 61.54 108.291 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -71.89 -34.68 69.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.992 -1.004 . . . . 53.54 111.123 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -23.69 67.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 64.12 110.942 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 51.7 m -80.97 -36.08 31.3 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.54 1.15 . . . . 73.41 108.317 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.74 -14.7 59.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.939 -1.028 . . . . 65.44 110.929 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.4 tp -105.19 -44.99 4.62 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.213 -0.448 . . . . 53.45 110.89 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 42.1 t -89.54 -43.08 14.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 71.42 111.104 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.71 -142.41 1.07 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.753 -0.737 . . . . 70.02 112.517 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 3.3 mtp85 -132.98 24.77 4.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.831 0.348 . . . . 74.55 110.827 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 50.1 m-70 -93.8 40.73 1.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 74.03 110.832 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 9.3 ptt85 -89.07 -39.74 13.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.277 -0.42 . . . . 71.25 110.875 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -94.8 3.8 54.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.199 -0.455 . . . . 73.1 110.851 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 48.5 m170 -79.95 120.18 23.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 74.3 110.855 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.84 143.89 50.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 62.22 110.891 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.7 m -139.69 -173.4 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.475 . . . . 55.41 111.089 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.231 -0.44 . . . . 30.42 111.097 179.907 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.085 0 CA-C-O 119.292 -0.385 . . . . 65.42 110.861 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -95.05 160.98 14.32 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 75.01 108.267 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.25 -55.63 20.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.961 -1.018 . . . . 62.54 110.883 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -84.56 -33.63 23.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.429 . . . . 73.21 110.859 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 178' ' ' HIS . . . . . 0.615 ' NE2' HD22 ' A' ' 197' ' ' LEU . 28.2 m80 -94.96 65.85 2.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.476 . . . . 74.31 110.872 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.64 -28.48 67.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.435 . . . . 64.4 110.9 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -93.23 35.1 1.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 52.21 110.843 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.402 ' OE2' HD12 ' A' ' 197' ' ' LEU . 0.4 OUTLIER -135.54 175.31 9.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 72.41 110.883 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.63 113.55 13.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 72.51 110.92 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 183' ' ' VAL . . . . . 0.789 HG11 HD22 ' A' ' 193' ' ' LEU . 16.0 m -51.43 160.94 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.424 . . . . 61.5 111.151 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -122.87 -39.21 2.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 74.42 110.826 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . 0.405 ' O ' HD23 ' A' ' 193' ' ' LEU . 0.0 OUTLIER -156.26 -169.4 3.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.471 . . . . 53.54 110.845 179.971 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.623 ' CE1' HG22 ' A' ' 188' ' ' VAL . 0.3 OUTLIER -133.31 138.84 46.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.224 -0.444 . . . . 71.24 110.894 -179.864 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.66 114.79 12.31 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.495 1.122 . . . . 75.45 108.274 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 188' ' ' VAL . . . . . 0.623 HG22 ' CE1' ' A' ' 186' ' ' TYR . 20.7 t -74.29 -30.53 26.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 114.992 -1.004 . . . . 73.43 111.145 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.58 -56.08 21.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 73.55 111.18 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.59 -5.2 56.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.265 -0.425 . . . . 74.21 110.921 179.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 23.8 t70 56.59 50.08 13.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 70.13 110.893 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -143.81 127.32 16.94 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.143 -0.48 . . . . 74.23 110.916 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 193' ' ' LEU . . . . . 0.789 HD22 HG11 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -51.33 151.02 3.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 73.44 110.944 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 194' ' ' ILE . . . . . 0.46 HG23 ' O ' ' A' ' 193' ' ' LEU . 1.0 OUTLIER -156.32 142.84 10.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 72.51 111.148 179.865 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.2 p -97.75 -175.19 3.1 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.524 1.14 . . . . 71.34 108.322 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.29 -32.69 66.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.0 -1.0 . . . . 33.11 111.118 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.615 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.2 OUTLIER -70.31 -22.2 62.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.26 -0.427 . . . . 71.34 110.858 -179.992 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 12.8 m -80.89 -33.6 34.16 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.446 1.091 . . . . 52.4 108.363 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -76.91 -15.6 59.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.977 -1.011 . . . . 74.12 110.9 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.9 tp -105.58 -45.15 4.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 73.24 110.879 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 201' ' ' VAL . . . . . 0.406 HG21 ' CD2' ' A' ' 197' ' ' LEU . 48.2 t -89.66 -42.8 14.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 53.55 111.207 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.48 -145.0 0.75 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.708 -0.758 . . . . 61.42 112.474 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -129.58 21.55 5.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.79 0.328 . . . . 74.33 110.907 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -99.28 39.86 1.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.244 -0.435 . . . . 51.42 110.864 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -94.24 -48.19 6.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 73.35 110.854 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -84.54 2.87 39.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.243 -0.435 . . . . 60.24 110.899 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.0 m170 -80.22 -176.75 5.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.461 . . . . 73.12 110.854 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -112.92 151.81 30.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 73.02 110.901 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.9 m -143.01 -175.88 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.462 . . . . 72.53 111.122 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 70.13 111.064 179.901 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.088 0 CA-C-O 119.252 -0.404 . . . . 61.12 110.892 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.92 161.0 1.76 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.505 1.128 . . . . 73.4 108.332 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 10.5 mp -73.58 -47.92 36.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.048 -0.978 . . . . 70.12 110.906 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -84.21 -42.26 16.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.213 -0.448 . . . . 74.1 110.875 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 178' ' ' HIS . . . . . 0.72 ' CD2' HD22 ' A' ' 197' ' ' LEU . 24.0 m80 -91.89 62.11 4.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.078 -0.51 . . . . 72.34 110.828 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.44 -29.88 26.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 74.13 110.858 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -93.99 34.98 1.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.156 -0.475 . . . . 73.04 110.942 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.8 96.68 2.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.149 -0.478 . . . . 74.5 110.848 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -56.76 132.67 52.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 74.4 110.899 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 183' ' ' VAL . . . . . 0.854 HG11 HD22 ' A' ' 193' ' ' LEU . 20.0 m -61.3 165.73 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 71.14 111.149 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -119.65 -35.54 3.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 74.24 110.864 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -162.43 -168.27 1.8 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 70.02 110.934 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.748 ' CZ ' HG22 ' A' ' 188' ' ' VAL . 0.3 OUTLIER -132.6 138.51 47.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.289 -0.414 . . . . 62.31 110.931 -179.855 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.8 114.08 10.55 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.506 1.129 . . . . 51.02 108.278 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 188' ' ' VAL . . . . . 0.748 HG22 ' CZ ' ' A' ' 186' ' ' TYR . 60.1 t -74.32 -29.55 24.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 114.972 -1.013 . . . . 71.51 111.083 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -56.23 18.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 75.23 111.171 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -90.79 -5.1 56.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 61.35 110.895 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 3.7 t0 56.99 50.62 11.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 74.45 110.851 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -144.06 127.34 16.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 43.03 110.899 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 193' ' ' LEU . . . . . 0.854 HD22 HG11 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -51.58 150.27 3.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.243 -0.435 . . . . 71.35 110.882 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 194' ' ' ILE . . . . . 0.454 HG23 ' O ' ' A' ' 193' ' ' LEU . 1.0 OUTLIER -156.27 142.6 10.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.194 -0.457 . . . . 74.42 111.157 179.849 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.5 p -95.8 -175.21 3.36 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 74.44 108.279 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.31 -32.72 66.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.993 -1.003 . . . . 63.0 111.096 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.72 HD22 ' CD2' ' A' ' 178' ' ' HIS . 0.1 OUTLIER -69.02 -24.04 64.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 72.43 110.859 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 23.4 m -81.27 -31.32 33.73 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.514 1.134 . . . . 45.44 108.336 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -76.46 -17.54 59.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.002 -0.999 . . . . 65.14 110.873 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.9 tp -105.99 -45.88 4.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 72.22 110.922 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 44.6 t -89.81 -43.3 14.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.203 -0.453 . . . . 34.24 111.106 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -67.72 -153.8 0.42 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 74.45 112.551 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -120.08 19.29 12.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.818 0.342 . . . . 54.51 110.852 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -96.26 47.49 1.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 70.11 110.861 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.11 -51.16 4.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.23 -0.441 . . . . 73.43 110.843 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.9 7.2 31.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.881 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 33.5 m170 -79.81 -176.41 5.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.47 . . . . 72.33 110.933 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -117.55 146.07 43.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 73.24 110.917 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.9 m -136.17 -174.51 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 64.55 111.157 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.454 . . . . 63.32 111.069 179.931 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 69.1 m . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.897 0.38 . . . . 71.43 110.843 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 23.3 t-80 -168.34 65.47 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 72.44 110.856 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 20.1 pt -104.58 37.64 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 74.3 111.149 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 27.6 mtp180 -141.67 148.2 38.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.155 -0.475 . . . . 74.23 110.851 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 152.59 161.5 10.29 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.726 -0.75 . . . . 73.35 112.497 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.415 ' O ' HG13 ' A' ' 183' ' ' VAL . 8.8 mt -119.09 56.96 0.89 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.873 0.368 . . . . 72.2 110.907 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -70.44 -173.57 0.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 64.54 110.873 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.2 161.09 29.66 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.438 1.086 . . . . 55.42 108.334 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 1.1 mp -74.1 -47.95 32.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.057 -0.974 . . . . 61.04 110.943 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.15 -36.02 23.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 75.15 110.902 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . 0.664 ' NE2' HD22 ' A' ' 197' ' ' LEU . 49.4 m80 -93.97 104.5 16.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.132 -0.485 . . . . 63.33 110.888 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.62 -32.83 25.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 65.23 110.869 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -94.95 34.71 1.33 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 62.01 110.845 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.635 ' OE2' HD12 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -155.71 113.08 3.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 63.42 110.885 -179.898 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.17 153.28 36.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 74.04 110.943 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' VAL . . . . . 0.834 HG11 HD22 ' A' ' 193' ' ' LEU . 12.7 m -53.59 174.52 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 61.14 111.14 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 55.5 t-20 -132.83 -40.86 0.94 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 73.4 110.928 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.1 -170.12 2.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 72.14 110.9 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.58 ' CE2' HG22 ' A' ' 188' ' ' VAL . 10.9 t80 -119.61 123.75 44.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 75.25 110.939 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.44 108.49 14.11 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.489 1.118 . . . . 55.33 108.35 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' VAL . . . . . 0.58 HG22 ' CE2' ' A' ' 186' ' ' TYR . 65.7 t -73.81 -26.79 21.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.013 -0.994 . . . . 71.12 111.123 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' THR . . . . . 0.725 HG23 ' HB2' ' A' ' 208' ' ' GLN . 0.8 OUTLIER -61.63 -56.73 16.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.193 -0.458 . . . . 75.33 111.181 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -89.91 -12.45 38.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.197 -0.456 . . . . 55.21 110.866 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 5.5 t0 64.33 58.67 1.08 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.209 -0.451 . . . . 52.3 110.944 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -162.52 124.39 2.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 73.51 110.92 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.834 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.81 149.33 6.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.174 -0.466 . . . . 73.31 110.896 -179.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -147.87 -178.87 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 55.23 111.192 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 20.4 p -125.7 -175.29 3.3 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.549 1.156 . . . . 44.13 108.308 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -73.15 -35.84 66.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.013 -0.994 . . . . 72.21 111.064 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.664 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.2 OUTLIER -64.67 -24.16 67.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.192 -0.458 . . . . 72.31 110.894 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 30.1 m -81.17 -34.87 32.09 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.558 1.161 . . . . 73.25 108.353 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 28.3 mtmt -76.89 -14.86 59.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.036 -0.983 . . . . 74.33 110.957 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 5.7 tp -105.35 -44.86 4.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 72.13 110.922 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' VAL . . . . . 0.578 HG21 HD23 ' A' ' 197' ' ' LEU . 47.2 t -89.73 -42.8 14.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.2 -0.455 . . . . 72.33 111.12 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -74.89 -142.33 0.84 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.79 -0.719 . . . . 54.41 112.48 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -129.08 23.95 5.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.855 0.359 . . . . 74.51 110.859 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -95.65 37.35 1.21 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 51.41 110.876 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 10.5 ptt-85 -94.31 -32.7 13.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 74.24 110.872 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -105.03 7.23 33.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 71.15 110.844 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 51.0 m170 -79.68 174.92 11.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 65.14 110.885 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . 0.725 ' HB2' HG23 ' A' ' 189' ' ' THR . 0.5 OUTLIER -99.23 144.46 28.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 63.02 110.961 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 34.0 m -146.21 -175.88 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.25 -0.432 . . . . 63.43 111.14 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -137.56 110.15 7.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 73.13 111.127 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -94.54 138.22 32.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.281 -0.418 . . . . 71.3 111.135 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 63.37 105.29 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 74.44 110.829 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 3.9 m -56.61 115.13 2.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 72.15 110.841 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.146 -0.479 . . . . 70.25 110.93 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 45.9 m . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.88 0.372 . . . . 72.15 110.847 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 25.2 m-70 -117.03 33.35 5.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.113 -0.494 . . . . 73.3 110.865 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . 0.437 HG23 ' H ' ' A' ' 172' ' ' GLY . 15.4 tt -77.42 -28.54 16.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 65.41 111.116 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 57.87 39.46 26.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 74.1 110.846 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . 0.437 ' H ' HG23 ' A' ' 170' ' ' ILE . . . -59.63 129.14 48.21 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.744 -0.741 . . . . 71.31 112.505 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.594 ' O ' HG22 ' A' ' 183' ' ' VAL . 1.3 mt -108.25 74.32 0.93 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.841 0.353 . . . . 53.22 110.911 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' MET . . . . . 0.44 ' HE1' ' HG2' ' A' ' 179' ' ' GLU . 0.0 OUTLIER -110.14 -169.82 1.54 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 71.25 110.857 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.04 161.13 20.82 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.477 1.111 . . . . 70.4 108.3 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.23 -53.47 29.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.003 -0.999 . . . . 71.42 110.882 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.4 -36.58 22.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.445 . . . . 72.12 110.863 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -91.08 90.39 7.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 74.11 110.803 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . 0.44 ' HG2' ' HE1' ' A' ' 174' ' ' MET . 1.2 mt-10 -86.27 4.85 37.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 74.21 110.921 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -120.03 34.69 5.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.118 -0.492 . . . . 73.4 110.859 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.88 -169.93 3.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 75.33 110.868 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.55 125.72 26.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 75.01 110.934 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' VAL . . . . . 0.594 HG22 ' O ' ' A' ' 173' ' ' LEU . 31.2 m -51.48 167.64 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 53.32 111.137 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -133.05 -51.19 0.89 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 74.12 110.864 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -148.87 -172.18 4.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 73.32 110.86 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -127.48 130.67 49.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.184 -0.462 . . . . 75.5 110.937 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.64 104.75 14.0 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.447 1.092 . . . . 63.44 108.313 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 43.1 t -73.26 -27.24 23.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 114.979 -1.009 . . . . 55.15 111.132 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.31 -55.41 24.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 71.32 111.145 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.05 -10.87 45.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 75.43 110.872 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 2.4 t70 64.45 59.25 1.0 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 55.43 110.887 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -161.86 127.08 3.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 62.32 110.917 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.476 HD22 ' CG1' ' A' ' 183' ' ' VAL . 0.2 OUTLIER -51.72 152.26 2.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 74.33 110.922 -179.986 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 194' ' ' ILE . . . . . 0.609 HD11 HG11 ' A' ' 209' ' ' VAL . 1.0 OUTLIER -144.64 142.86 23.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.444 . . . . 55.13 111.157 179.815 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 19.6 p -104.41 -175.09 2.7 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.507 1.129 . . . . 64.23 108.331 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -68.73 -39.03 80.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.024 -0.989 . . . . 72.12 111.078 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.16 -18.45 64.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 65.44 110.924 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 5.7 m -80.97 -33.48 33.82 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.524 1.14 . . . . 61.23 108.306 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.33 -15.52 59.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.978 -1.01 . . . . 64.23 110.925 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 tp -105.3 -44.75 4.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 75.04 110.887 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 49.0 t -89.85 -42.49 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 71.34 111.14 179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -77.87 -146.59 2.79 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.762 -0.733 . . . . 55.31 112.471 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -134.24 24.25 3.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.852 0.358 . . . . 75.1 110.837 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . 0.518 ' CG ' HG21 ' A' ' 194' ' ' ILE . 89.6 m-70 -95.99 38.68 1.17 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 71.12 110.842 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 10.3 ttm-85 -94.18 -47.69 6.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 64.02 110.878 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.49 7.14 40.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.199 -0.455 . . . . 75.14 110.83 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -79.94 174.94 11.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 74.52 110.847 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.64 143.97 25.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 75.03 110.916 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 209' ' ' VAL . . . . . 0.609 HG11 HD11 ' A' ' 194' ' ' ILE . 26.9 m -150.71 -176.22 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 74.54 111.133 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -139.34 -170.54 2.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 74.13 111.087 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -128.66 168.04 16.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 52.21 111.096 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -158.28 163.67 37.17 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.218 -0.447 . . . . 75.12 110.925 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 63.19 -172.02 0.17 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 62.22 110.861 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 44.23 110.865 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 70.0 m . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.926 0.393 . . . . 64.35 110.832 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 19.6 m-70 -55.87 130.01 41.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.122 -0.49 . . . . 74.43 110.823 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 11.8 tt -141.64 146.24 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 75.4 111.058 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -129.72 171.93 12.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 73.42 110.888 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . 0.474 ' O ' HD22 ' A' ' 173' ' ' LEU . . . -111.9 -166.99 17.96 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.727 -0.749 . . . . 42.51 112.467 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.474 HD22 ' O ' ' A' ' 172' ' ' GLY . 4.1 mm? -127.06 104.88 8.22 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.818 0.342 . . . . 75.24 110.93 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.3 -174.19 4.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 75.42 110.879 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -72.34 163.44 27.97 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.513 1.133 . . . . 74.32 108.285 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.63 -52.44 17.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.99 -1.005 . . . . 51.23 110.901 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -84.05 -37.15 22.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 73.52 110.941 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . 0.624 ' NE2' HD22 ' A' ' 197' ' ' LEU . 29.3 m80 -88.66 91.71 8.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 73.54 110.882 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -26.29 53.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.239 -0.437 . . . . 72.32 110.87 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -97.93 34.41 1.91 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.232 -0.44 . . . . 65.45 110.891 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.61 ' OE2' HD12 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -156.29 113.09 3.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 70.43 110.9 -179.849 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.3 149.83 40.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 65.44 110.933 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' VAL . . . . . 0.835 HG11 HD22 ' A' ' 193' ' ' LEU . 15.9 m -53.59 175.17 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.289 -0.414 . . . . 55.42 111.19 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -131.04 -40.05 1.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 72.11 110.847 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.15 -170.18 2.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 71.41 110.95 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.537 ' CE2' HG22 ' A' ' 188' ' ' VAL . 14.8 t80 -117.15 124.64 49.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.277 -0.419 . . . . 74.14 110.93 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -81.35 107.98 14.58 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.552 1.157 . . . . 73.13 108.258 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 188' ' ' VAL . . . . . 0.537 HG22 ' CE2' ' A' ' 186' ' ' TYR . 91.4 t -74.08 -28.67 23.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.024 -0.989 . . . . 73.43 111.085 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.86 -56.47 20.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 72.42 111.149 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.69 -12.36 39.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.242 -0.436 . . . . 63.24 110.916 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 6.2 t0 64.0 56.36 1.44 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 53.22 110.881 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -161.0 122.99 3.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.453 . . . . 74.14 110.931 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.835 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -50.7 148.64 3.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.138 -0.483 . . . . 64.11 110.943 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -147.33 -178.87 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.252 -0.431 . . . . 72.25 111.153 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 18.6 p -125.23 -175.44 3.31 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.49 1.119 . . . . 62.34 108.323 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -74.29 -36.12 63.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.057 -0.974 . . . . 70.4 111.069 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.624 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.3 OUTLIER -60.67 -27.42 67.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 64.15 111.006 180.0 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 67.0 m -81.03 -35.11 32.29 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.447 1.092 . . . . 52.03 108.341 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -76.85 -14.96 59.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.998 -1.001 . . . . 74.43 110.911 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.5 tp -105.32 -44.93 4.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.182 -0.463 . . . . 34.12 110.926 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 45.0 t -89.67 -42.87 14.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 73.55 111.111 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.43 -142.93 1.04 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.742 -0.742 . . . . 72.34 112.453 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -129.7 24.79 5.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.84 0.352 . . . . 61.21 110.878 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -92.36 43.99 1.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 74.02 110.882 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.65 -47.08 7.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.45 . . . . 73.22 110.868 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -88.15 6.95 34.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 75.14 110.848 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 41.7 m170 -81.94 120.33 25.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 74.33 110.87 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.96 143.9 50.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.218 -0.446 . . . . 63.22 110.933 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.8 m -140.92 -173.57 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 72.42 111.16 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -124.81 109.1 12.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 72.33 111.122 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -83.81 124.47 30.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.283 -0.417 . . . . 70.01 111.064 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 4.6 tp -126.94 140.68 52.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.477 . . . . 72.03 110.884 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 4.1 t -154.68 121.19 5.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 74.31 110.863 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.106 -0.497 . . . . 55.32 110.876 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 17.5 p . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.908 0.385 . . . . 73.41 110.843 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 11.4 t60 -86.85 109.13 19.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 72.44 110.859 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 17.0 tt -148.89 142.84 18.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 74.21 111.185 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -126.61 144.34 50.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.193 -0.458 . . . . 71.55 110.842 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -105.46 121.99 7.03 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.742 -0.742 . . . . 75.11 112.524 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.562 ' O ' HG22 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -86.49 140.41 29.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.749 0.309 . . . . 71.53 110.956 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -110.0 175.5 5.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.277 -0.42 . . . . 61.31 110.93 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -59.87 165.19 3.32 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.505 1.128 . . . . 54.42 108.306 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.28 -52.82 12.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.003 -0.999 . . . . 75.14 110.824 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -84.12 -37.39 22.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 72.35 110.817 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 27.5 m80 -87.48 120.09 28.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 74.23 110.845 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -98.66 -31.65 11.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 64.22 110.892 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -95.88 34.59 1.5 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.486 . . . . 63.01 110.883 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.515 ' CD ' HD13 ' A' ' 197' ' ' LEU . 1.7 mp0 -153.48 90.3 1.4 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 73.02 110.935 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -57.33 147.32 26.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.446 . . . . 73.32 110.92 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' VAL . . . . . 0.752 HG11 HD22 ' A' ' 193' ' ' LEU . 21.8 m -51.86 171.11 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.273 -0.421 . . . . 63.3 111.172 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -132.45 -39.39 1.02 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.213 -0.449 . . . . 50.32 110.897 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.07 -169.95 1.99 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 72.32 110.88 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.679 ' CE2' HG22 ' A' ' 188' ' ' VAL . 9.0 t80 -123.32 124.88 43.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.261 -0.427 . . . . 64.32 110.921 -179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 187' ' ' CYS . . . . . 0.456 ' HA ' HG12 ' A' ' 209' ' ' VAL . 0.1 OUTLIER -83.99 110.22 18.26 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.482 1.114 . . . . 62.33 108.366 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 188' ' ' VAL . . . . . 0.679 HG22 ' CE2' ' A' ' 186' ' ' TYR . 62.0 t -75.3 -40.71 43.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 114.95 -1.023 . . . . 75.02 111.081 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 189' ' ' THR . . . . . 0.4 HG23 ' N ' ' A' ' 190' ' ' ASP . 3.4 t -51.68 -44.61 63.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 64.13 111.117 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . 0.4 ' N ' HG23 ' A' ' 189' ' ' THR . 11.7 m-20 -97.49 -16.28 20.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.45 . . . . 64.21 110.774 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 9.4 t0 63.88 58.08 1.27 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.245 -0.434 . . . . 72.33 110.869 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -163.5 121.19 1.87 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.22 -0.446 . . . . 71.41 110.943 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.752 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -50.86 148.77 3.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.256 -0.429 . . . . 74.3 110.861 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.1 pp -144.55 -179.49 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 65.34 111.132 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.9 p -128.02 -175.56 3.53 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.47 1.106 . . . . 74.32 108.368 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.57 -34.02 67.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.027 -0.988 . . . . 62.32 111.027 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.515 HD13 ' CD ' ' A' ' 181' ' ' GLU . 0.5 OUTLIER -70.18 -20.54 63.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 71.52 110.989 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 4.5 m -81.18 -35.52 31.31 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.538 1.149 . . . . 42.12 108.29 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -76.83 -14.88 59.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.07 -0.968 . . . . 75.34 110.866 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 tp -105.23 -44.92 4.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.247 -0.433 . . . . 72.22 110.93 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 43.3 t -89.65 -43.01 14.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.22 -0.445 . . . . 72.41 111.143 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -74.48 -142.07 0.75 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.742 -0.742 . . . . 73.11 112.429 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 11.3 mtp180 -128.87 24.09 5.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.875 0.369 . . . . 64.51 110.883 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -94.59 38.27 1.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 73.25 110.901 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -94.09 -34.18 13.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 65.41 110.865 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -104.99 7.3 34.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 72.14 110.837 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -79.72 -175.88 5.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.834 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.09 143.86 45.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.456 . . . . 74.24 110.958 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 209' ' ' VAL . . . . . 0.456 HG12 ' HA ' ' A' ' 187' ' ' CYS . 31.4 m -143.12 -176.39 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.233 -0.44 . . . . 74.44 111.169 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -120.93 105.4 10.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 71.53 111.071 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -92.41 -178.8 5.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.206 -0.452 . . . . 75.31 111.105 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.83 171.49 14.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.24 -0.437 . . . . 75.45 110.849 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.73 -175.32 2.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.113 -0.494 . . . . 73.44 110.848 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.106 -0.497 . . . . 61.45 110.917 -179.978 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 2.8 t . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.898 0.38 . . . . 73.23 110.851 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -120.43 55.11 1.03 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 71.5 110.889 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 58.5 mt -110.65 -59.47 3.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 53.14 111.092 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 62.75 179.36 0.14 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.192 -0.458 . . . . 74.33 110.874 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 145.32 -128.82 3.26 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.711 -0.757 . . . . 73.53 112.478 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.734 ' O ' HG22 ' A' ' 183' ' ' VAL . 1.5 mp -120.21 89.66 3.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.793 0.33 . . . . 72.13 110.907 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.52 -170.15 1.59 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.216 -0.447 . . . . 74.14 110.882 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -93.86 163.18 13.61 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.521 1.138 . . . . 71.12 108.318 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.97 -53.01 22.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.031 -0.986 . . . . 73.21 110.886 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.36 -36.81 22.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 75.34 110.891 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . 0.505 ' NE2' HD22 ' A' ' 197' ' ' LEU . 48.3 m80 -89.29 88.34 7.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.133 -0.485 . . . . 74.32 110.882 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.31 -23.99 46.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 74.45 110.918 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -95.4 34.57 1.43 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.097 -0.501 . . . . 74.24 110.888 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -152.3 172.83 15.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 52.25 110.884 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.11 139.11 53.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.097 -0.502 . . . . 63.41 110.834 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' VAL . . . . . 0.843 HG11 HD22 ' A' ' 193' ' ' LEU . 8.1 m -50.9 169.3 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 71.33 111.15 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -130.39 -43.09 1.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 74.0 110.857 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -154.46 -172.81 4.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 74.33 110.853 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -124.07 127.76 48.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.28 -0.418 . . . . 75.23 110.905 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -82.07 107.21 14.59 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.513 1.133 . . . . 52.31 108.3 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 40.2 t -73.71 -26.76 22.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 114.994 -1.003 . . . . 72.43 111.125 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 189' ' ' THR . . . . . 0.516 HG23 ' HB2' ' A' ' 208' ' ' GLN . 0.0 OUTLIER -62.1 -56.16 21.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.226 -0.443 . . . . 73.34 111.131 -179.875 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.32 -12.39 37.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 71.55 110.869 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 1.9 t70 64.27 58.61 1.1 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 65.35 110.874 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -159.22 118.35 2.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 72.05 110.85 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.843 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -50.74 148.83 3.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 45.32 110.856 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -147.41 -179.87 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.452 . . . . 73.04 111.144 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 23.3 p -123.46 -175.68 3.26 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.445 1.091 . . . . 45.4 108.339 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -71.82 -34.3 69.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.992 -1.004 . . . . 64.52 111.104 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.505 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.2 OUTLIER -69.5 -20.5 63.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 62.31 110.928 179.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 8.1 m -80.87 -35.99 31.91 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.477 1.11 . . . . 61.14 108.312 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 33.4 mtmt -77.17 -14.35 59.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.004 -0.998 . . . . 64.03 110.921 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.1 tp -105.14 -44.61 4.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.239 -0.437 . . . . 74.04 110.962 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' VAL . . . . . 0.446 HG21 ' CD2' ' A' ' 197' ' ' LEU . 44.1 t -89.68 -42.86 14.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.187 -0.46 . . . . 74.04 111.096 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.79 -140.67 0.91 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.72 -0.752 . . . . 74.54 112.47 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 80.0 mtm180 -132.51 22.78 4.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.853 0.359 . . . . 75.2 110.896 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -96.95 38.64 1.22 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.179 -0.464 . . . . 73.23 110.832 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 4.3 ttt85 -94.25 -43.95 8.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 65.13 110.839 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -93.71 7.13 45.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 73.35 110.812 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.8 m170 -79.78 174.84 11.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 73.15 110.852 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . 0.516 ' HB2' HG23 ' A' ' 189' ' ' THR . 0.5 OUTLIER -93.41 143.79 25.95 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.193 -0.458 . . . . 74.52 110.881 -179.926 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 29.9 m -150.32 -175.03 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 45.32 111.167 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -140.87 -169.84 2.9 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.211 -0.45 . . . . 55.32 111.073 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -142.08 -173.42 3.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 43.41 111.122 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -126.51 106.57 9.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.188 -0.46 . . . . 62.41 110.967 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.84 159.26 15.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 71.41 110.842 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 . . . . . 0 C--N 1.331 -0.232 0 CA-C-N 116.077 -0.51 . . . . 74.32 110.837 179.995 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.896 0.379 . . . . 63.52 110.899 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 4.4 m170 -97.27 -28.74 13.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.166 -0.47 . . . . 73.34 110.807 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 1.1 pp -54.16 -28.13 17.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.214 -0.448 . . . . 73.2 111.126 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.64 129.6 33.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.124 -0.489 . . . . 55.11 110.888 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 159.7 -51.21 0.38 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.761 -0.733 . . . . 72.31 112.538 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.48 ' O ' HG22 ' A' ' 183' ' ' VAL . 14.3 tp 63.53 106.22 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.821 0.343 . . . . 63.13 110.875 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' MET . . . . . 0.437 ' HA ' HG13 ' A' ' 183' ' ' VAL . 0.0 OUTLIER -110.06 174.45 5.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 63.41 110.826 179.776 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -55.02 163.28 1.07 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.544 1.153 . . . . 74.12 108.34 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.82 -54.69 10.65 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.048 -0.978 . . . . 73.42 110.917 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -84.22 -36.88 22.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 63.14 110.941 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 10.0 m170 -88.93 64.2 7.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 62.32 110.833 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -24.52 52.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 52.14 110.896 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -95.54 34.71 1.43 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 65.34 110.775 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.499 ' CD ' HD13 ' A' ' 197' ' ' LEU . 0.3 OUTLIER -154.71 103.48 2.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 74.41 110.96 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.5 151.98 9.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 71.24 110.94 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' VAL . . . . . 0.722 HG11 HD22 ' A' ' 193' ' ' LEU . 27.6 m -69.67 172.15 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.457 . . . . 63.24 111.073 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -129.46 -45.55 1.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 71.01 110.892 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.11 -170.1 3.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 72.2 110.895 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -123.59 129.25 50.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 74.24 110.902 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -85.78 106.4 17.0 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.548 1.155 . . . . 63.43 108.264 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 99.7 t -75.01 -39.89 44.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 114.948 -1.024 . . . . 70.4 111.127 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 1.2 t -51.34 -39.18 56.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 63.01 111.107 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -106.75 -9.5 16.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.296 -0.411 . . . . 63.2 110.841 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 5.7 t70 61.43 55.2 2.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 75.54 110.868 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.65 127.5 6.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 75.24 110.876 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.722 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -50.89 152.36 2.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.214 -0.448 . . . . 74.4 110.906 179.963 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -146.29 143.25 21.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.193 -0.458 . . . . 73.3 111.124 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 14.8 p -101.09 -175.4 2.86 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.554 1.159 . . . . 72.21 108.343 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -71.3 -41.28 70.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.062 -0.972 . . . . 72.11 111.11 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.499 HD13 ' CD ' ' A' ' 181' ' ' GLU . 0.4 OUTLIER -58.23 -25.35 61.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.288 -0.414 . . . . 73.04 110.919 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 62.9 m -81.22 -33.83 32.6 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.449 1.093 . . . . 64.24 108.301 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.38 -16.07 59.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.045 -0.979 . . . . 72.3 110.941 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.7 tp -105.68 -45.67 4.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 60.44 110.897 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 42.1 t -89.66 -43.21 14.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 73.51 111.192 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -72.86 -149.3 1.04 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.745 -0.74 . . . . 64.05 112.509 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.21 22.5 4.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.818 0.342 . . . . 63.2 110.843 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -90.04 47.94 1.51 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 64.3 110.901 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -94.07 -49.41 5.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.91 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -82.12 0.48 40.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.466 . . . . 75.24 110.864 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 38.6 m170 -79.85 120.9 24.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.252 -0.431 . . . . 72.22 110.821 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.53 153.9 18.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 73.05 110.931 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.5 m -147.7 -172.99 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 73.43 111.136 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -128.03 107.17 9.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 52.45 111.103 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -84.4 130.65 34.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.199 -0.455 . . . . 63.21 111.096 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 3.7 mp -77.2 171.78 14.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 72.44 110.899 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.2 t -175.88 114.39 0.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 75.33 110.889 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.109 -0.496 . . . . 53.4 110.91 179.987 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.983 0.421 . . . . 72.34 110.888 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -124.13 148.98 46.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.109 -0.496 . . . . 73.24 110.892 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 2.6 mp -119.57 -61.63 2.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 70.44 111.128 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 4.7 mtp180 -67.14 164.47 17.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.19 -0.459 . . . . 71.34 110.875 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 141.62 80.52 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.768 -0.73 . . . . 44.25 112.442 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 92.0 mt -133.16 77.57 1.74 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.79 0.329 . . . . 74.05 110.832 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -78.87 -173.07 3.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 75.31 110.811 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -77.01 162.0 27.89 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.566 1.166 . . . . 53.05 108.272 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.7 mp -71.62 -50.65 28.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.964 -1.017 . . . . 74.54 110.97 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -84.14 -38.74 20.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.183 -0.462 . . . . 72.41 110.894 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . 0.627 ' NE2' HD22 ' A' ' 197' ' ' LEU . 40.6 m80 -88.49 110.85 21.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 73.21 110.9 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -90.4 -32.99 16.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 61.1 110.915 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -95.23 34.78 1.37 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.074 -0.512 . . . . 74.1 110.862 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.608 ' HG3' HD12 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -154.32 106.54 2.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 75.12 110.881 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 8.2 mtpp -72.48 149.4 44.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.505 . . . . 70.24 110.882 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' VAL . . . . . 0.858 HG11 HD22 ' A' ' 193' ' ' LEU . 12.6 m -51.24 169.51 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.243 -0.435 . . . . 42.41 111.135 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -127.74 -38.76 1.85 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 72.31 110.909 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.3 -170.04 1.97 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 62.14 110.836 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -118.46 127.98 54.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 74.44 110.881 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -82.13 108.47 15.63 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.561 1.163 . . . . 72.21 108.248 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 61.6 t -73.81 -27.39 22.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 114.994 -1.003 . . . . 65.3 111.142 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.32 -55.78 24.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 52.44 111.113 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.58 -11.27 40.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.436 . . . . 63.13 110.842 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 18.4 t0 63.63 54.15 1.92 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 61.51 110.803 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -157.73 126.07 5.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.246 -0.434 . . . . 54.1 110.881 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.858 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.13 150.91 4.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 70.44 110.924 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.7 pp -149.88 -179.4 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 74.43 111.107 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 17.5 p -126.78 -175.63 3.46 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.431 1.082 . . . . 64.43 108.294 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -73.12 -38.24 66.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.064 -0.971 . . . . 63.33 111.145 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.627 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.3 OUTLIER -59.03 -27.43 65.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 72.22 110.969 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 67.6 m -81.01 -34.07 33.18 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.514 1.134 . . . . 71.01 108.3 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -76.22 -15.42 60.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.977 -1.01 . . . . 75.4 110.911 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.73 -45.54 4.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 71.1 110.92 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' VAL . . . . . 0.566 ' CG2' HD23 ' A' ' 197' ' ' LEU . 53.5 t -89.64 -43.0 14.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.158 -0.474 . . . . 42.33 111.143 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.58 -146.55 0.93 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.667 -0.778 . . . . 64.44 112.469 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 53.2 ttt180 -128.12 24.68 5.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.771 0.32 . . . . 75.23 110.884 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 62.2 m-70 -94.12 39.91 1.08 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 74.21 110.856 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 7.7 ttm-85 -87.34 -45.66 10.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 74.42 110.856 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -89.57 5.53 45.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.178 -0.465 . . . . 72.42 110.854 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 41.5 m170 -81.04 120.17 24.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.218 -0.446 . . . . 64.3 110.882 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.94 143.89 50.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 72.34 110.875 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 19.0 m -140.37 -173.58 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 73.04 111.098 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -117.48 102.69 9.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 73.5 111.117 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -89.03 93.34 9.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 72.11 111.106 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 1.3 tp 63.07 177.98 0.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 73.41 110.938 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 6.1 m -82.67 127.22 33.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.459 . . . . 75.25 110.839 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.141 -0.482 . . . . 73.32 110.893 179.986 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 49.1 m . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.891 0.377 . . . . 65.32 110.919 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 62.2 m80 -136.29 90.89 2.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 72.02 110.85 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 63.4 mt -121.92 94.51 2.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.19 -0.459 . . . . 61.11 111.124 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 4.6 mtt180 -97.1 38.1 1.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 64.32 110.834 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -79.75 141.44 23.57 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.714 -0.755 . . . . 44.1 112.568 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.592 ' O ' HG22 ' A' ' 183' ' ' VAL . 0.5 OUTLIER -129.35 100.16 5.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.813 0.34 . . . . 33.22 110.916 -179.797 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.21 -173.23 2.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 75.31 110.923 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -75.98 161.19 29.12 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.505 1.128 . . . . 51.52 108.307 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 10.6 mp -70.63 -51.74 25.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.027 -0.988 . . . . 70.32 110.989 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -84.03 -35.23 23.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.458 . . . . 64.33 110.899 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 22.6 m80 -94.64 93.74 7.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.106 -0.497 . . . . 70.13 110.859 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.03 -23.81 38.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.459 . . . . 74.01 110.857 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -95.44 34.62 1.43 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 75.04 110.872 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.75 112.98 1.94 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 50.02 110.894 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 14.4 pttt -72.11 146.08 47.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 71.05 110.882 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' VAL . . . . . 0.813 HG11 HD22 ' A' ' 193' ' ' LEU . 31.6 m -51.94 171.25 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.197 -0.456 . . . . 63.52 111.147 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -132.33 -38.72 1.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.169 -0.469 . . . . 63.22 110.89 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -158.61 -170.1 2.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 55.25 110.884 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -129.0 128.11 43.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 74.3 110.878 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -83.64 109.78 17.73 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.431 1.082 . . . . 74.43 108.294 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 39.6 t -75.27 -42.19 43.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 114.961 -1.018 . . . . 75.43 111.068 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 189' ' ' THR . . . . . 0.403 HG23 ' N ' ' A' ' 190' ' ' ASP . 3.5 t -51.69 -44.14 63.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 74.33 111.113 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . 0.403 ' N ' HG23 ' A' ' 189' ' ' THR . 9.0 m-20 -97.5 -14.95 20.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 73.14 110.868 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.85 56.54 1.86 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 63.34 110.847 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -158.77 120.36 3.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.465 . . . . 75.44 110.927 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.813 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.25 148.91 5.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 72.24 110.875 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -144.88 -179.77 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.19 -0.459 . . . . 61.44 111.072 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.1 p -126.82 -175.52 3.43 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.592 1.183 . . . . 75.24 108.34 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.87 -32.68 65.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.002 -0.999 . . . . 45.35 111.077 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.86 -21.09 62.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 71.14 110.955 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 6.8 m -81.17 -35.35 31.55 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.485 1.116 . . . . 64.12 108.333 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? -76.96 -14.69 59.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.987 -1.006 . . . . 71.24 110.945 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.2 tp -105.38 -44.82 4.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 73.32 110.878 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 44.1 t -89.71 -42.91 14.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 61.44 111.131 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.54 -142.45 1.02 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.78 -0.724 . . . . 60.51 112.467 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 5.2 mtt85 -132.38 23.27 4.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.879 0.371 . . . . 71.33 110.881 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -94.55 38.36 1.11 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.162 -0.472 . . . . 70.3 110.825 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -94.22 -42.46 8.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.246 -0.433 . . . . 65.34 110.809 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -94.85 7.19 46.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.222 -0.444 . . . . 50.2 110.874 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.3 m170 -79.84 176.13 10.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 63.42 110.857 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.91 143.94 26.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 74.13 110.889 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 32.8 m -150.24 -175.61 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 73.52 111.198 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -143.21 106.93 4.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 72.1 111.072 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -76.63 137.39 39.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.259 -0.428 . . . . 64.45 111.126 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.92 164.39 14.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 71.31 110.885 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 68.7 m -111.06 47.16 1.01 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 64.41 110.885 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.142 -0.481 . . . . 62.45 110.852 -179.971 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 3.2 t . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.957 0.408 . . . . 71.01 110.862 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 3.6 p80 -119.71 39.08 3.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.065 -0.516 . . . . 71.24 110.837 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 58.4 mt -108.62 -28.72 2.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 61.14 111.097 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 41.9 mtt180 54.46 90.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 73.42 110.889 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 159.36 -161.57 32.2 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.737 -0.744 . . . . 64.32 112.508 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.559 ' O ' HG22 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -143.61 46.56 1.48 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.812 0.339 . . . . 71.35 110.895 -179.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -105.23 -174.0 2.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 71.23 110.937 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -81.36 160.96 23.98 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.481 1.113 . . . . 74.45 108.269 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.0 mp -76.43 -45.96 29.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.927 -1.033 . . . . 63.5 110.944 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -84.4 -34.79 23.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 73.31 110.854 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . 0.747 ' CD2' HD22 ' A' ' 197' ' ' LEU . 37.8 m80 -99.44 78.49 2.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.137 -0.483 . . . . 75.22 110.878 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -62.74 -31.1 71.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.235 -0.438 . . . . 75.31 110.919 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -94.31 34.72 1.25 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.171 -0.468 . . . . 63.44 110.806 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.69 112.83 3.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.279 -0.418 . . . . 63.2 110.916 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 18.3 mtpt -72.51 144.62 47.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.185 -0.461 . . . . 61.51 110.845 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' VAL . . . . . 0.796 HG11 HD22 ' A' ' 193' ' ' LEU . 29.3 m -51.51 170.56 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.19 -0.459 . . . . 74.44 111.18 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -131.85 -38.71 1.12 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.449 . . . . 63.04 110.912 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.69 -170.03 2.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.197 -0.456 . . . . 74.32 110.868 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -128.54 127.98 43.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 75.14 110.949 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -83.72 109.84 17.82 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.45 1.094 . . . . 70.51 108.265 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 22.0 t -75.23 -42.11 44.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 114.939 -1.028 . . . . 71.35 111.132 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 189' ' ' THR . . . . . 0.402 HG23 ' N ' ' A' ' 190' ' ' ASP . 3.5 t -51.69 -44.07 63.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 72.42 111.154 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . 0.402 ' N ' HG23 ' A' ' 189' ' ' THR . 9.4 m-20 -97.56 -15.03 20.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.157 -0.474 . . . . 62.44 110.843 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 62.85 56.54 1.86 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.189 -0.46 . . . . 72.22 110.913 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -159.04 120.25 3.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 74.31 110.917 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.796 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.17 148.87 5.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 75.51 110.905 -179.961 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -145.37 -179.63 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 75.02 111.099 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 25.6 p -126.74 -175.55 3.44 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.544 1.153 . . . . 72.21 108.317 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.81 -33.03 65.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.97 -1.014 . . . . 75.32 111.131 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.747 HD22 ' CD2' ' A' ' 178' ' ' HIS . 0.1 OUTLIER -70.43 -20.98 62.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.45 . . . . 63.44 110.947 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 7.7 m -81.26 -35.44 31.16 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.52 1.138 . . . . 74.22 108.288 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 26.0 mtmt -77.02 -14.77 59.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.99 -1.004 . . . . 75.33 110.886 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.3 tp -105.18 -44.7 4.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.232 -0.44 . . . . 71.04 110.938 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' VAL . . . . . 0.636 HG21 HD23 ' A' ' 197' ' ' LEU . 44.3 t -89.71 -42.81 14.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 72.12 111.075 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.96 -141.64 1.06 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.733 -0.746 . . . . 44.1 112.455 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 58.2 mtp180 -132.65 23.62 4.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.806 0.336 . . . . 73.25 110.819 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -94.78 37.95 1.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.235 -0.439 . . . . 64.41 110.894 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -94.14 -42.06 9.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.25 -0.432 . . . . 75.24 110.865 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 13.4 p-10 -95.34 7.14 47.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 64.12 110.895 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -79.79 177.16 9.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 74.2 110.913 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -96.99 143.94 27.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 54.23 110.932 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 34.5 m -150.4 -175.99 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 63.43 111.128 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -135.68 119.27 17.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 71.34 111.083 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -95.62 113.47 25.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 51.31 111.111 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.86 158.56 33.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.281 -0.418 . . . . 73.32 110.893 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.92 146.32 45.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.451 . . . . 73.0 110.873 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.462 . . . . 73.44 110.9 -179.977 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.91 0.386 . . . . 63.33 110.883 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 10.5 m-70 -100.82 -50.55 3.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 74.4 110.869 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 10.5 pt -126.0 146.83 31.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.155 -0.475 . . . . 63.32 111.106 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.92 146.23 40.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 74.53 110.846 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 148.24 -35.88 1.13 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.724 -0.75 . . . . 42.5 112.513 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.48 ' O ' HG22 ' A' ' 183' ' ' VAL . 1.9 tp 63.54 106.4 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.844 0.354 . . . . 73.32 110.937 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.04 -169.93 1.56 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.265 -0.425 . . . . 74.21 110.833 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.39 160.93 25.21 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.445 1.091 . . . . 72.31 108.283 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 2.5 mp -66.3 -55.29 16.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.984 -1.007 . . . . 73.23 110.929 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -84.35 -33.73 23.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.249 -0.432 . . . . 64.1 110.895 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -94.6 75.01 3.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 74.1 110.832 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -25.42 67.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 51.14 110.895 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.55 34.6 1.45 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.107 -0.497 . . . . 73.24 110.86 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -130.47 -172.61 2.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 61.35 110.916 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.9 mttp -136.95 120.88 17.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.226 -0.443 . . . . 65.22 110.896 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' VAL . . . . . 0.48 HG22 ' O ' ' A' ' 173' ' ' LEU . 19.8 m -51.31 165.03 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 72.33 111.183 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -134.05 -50.87 0.83 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 64.13 110.844 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . 0.425 ' O ' HD23 ' A' ' 193' ' ' LEU . 0.0 OUTLIER -154.88 -170.1 3.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.187 -0.46 . . . . 55.34 110.932 179.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -127.12 129.56 48.16 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.323 -0.398 . . . . 70.11 110.951 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.33 105.31 14.18 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.477 1.111 . . . . 73.42 108.24 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 58.8 t -73.27 -26.16 22.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 114.966 -1.015 . . . . 74.45 111.12 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.6 -55.79 20.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 63.31 111.198 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -89.76 -10.32 46.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 40.44 110.866 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 6.1 t70 64.15 58.25 1.17 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.177 -0.465 . . . . 63.0 110.862 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -160.22 127.13 4.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 52.51 110.893 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.425 HD23 ' O ' ' A' ' 185' ' ' MET . 0.2 OUTLIER -51.35 152.64 2.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 40.24 110.962 179.985 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 194' ' ' ILE . . . . . 0.557 HD11 HG11 ' A' ' 209' ' ' VAL . 1.0 OUTLIER -144.84 142.77 22.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 73.33 111.087 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 14.8 p -107.12 -174.32 2.51 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.475 1.109 . . . . 72.23 108.31 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.37 -44.45 78.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.032 -0.985 . . . . 72.41 111.088 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -20.35 62.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.449 . . . . 75.04 110.914 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 24.8 m -80.82 -32.55 35.16 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.497 1.123 . . . . 75.24 108.325 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 4.5 mtpm? -77.34 -15.85 59.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.027 -0.988 . . . . 73.13 110.9 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.6 tp -105.38 -44.85 4.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.463 . . . . 61.03 110.912 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 61.5 t -89.82 -42.57 14.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.215 -0.448 . . . . 73.2 111.118 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -78.25 -148.79 3.89 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.739 -0.743 . . . . 15.33 112.478 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 8.3 ttm180 -134.25 24.75 3.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.799 0.333 . . . . 74.03 110.841 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . 0.506 ' CG ' HG21 ' A' ' 194' ' ' ILE . 92.5 m-70 -95.47 38.84 1.14 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 74.01 110.858 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 3.6 ttp85 -94.22 -48.0 6.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.244 -0.434 . . . . 70.34 110.842 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -90.39 7.36 39.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 64.01 110.867 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 31.5 m170 -79.94 175.01 11.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 74.54 110.896 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 52.0 mm-40 -95.03 147.55 23.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.29 -0.414 . . . . 70.43 110.952 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 209' ' ' VAL . . . . . 0.557 HG11 HD11 ' A' ' 194' ' ' ILE . 35.9 m -150.33 -176.06 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 53.14 111.128 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -121.99 101.96 7.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.46 . . . . 64.41 111.132 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -66.81 146.53 54.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 55.01 111.133 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.01 124.6 29.92 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.228 -0.442 . . . . 54.13 110.865 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 6.1 p -96.2 168.18 10.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.128 -0.487 . . . . 72.41 110.779 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 116.098 -0.501 . . . . 54.21 110.873 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.843 0.354 . . . . 72.43 110.898 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -83.92 -60.51 2.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 73.42 110.804 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 9.5 tp -59.46 133.81 24.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 75.52 111.116 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.07 -174.3 1.22 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 75.52 110.827 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 132.56 129.62 3.02 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.697 -0.763 . . . . 21.11 112.506 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -119.87 95.57 4.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.821 0.343 . . . . 74.0 110.929 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -52.18 165.25 0.23 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.161 -0.472 . . . . 75.11 110.944 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -54.9 161.26 1.66 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.494 1.121 . . . . 45.52 108.301 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.2 mp -68.63 -54.77 14.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.969 -1.014 . . . . 71.31 110.905 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -83.98 -35.43 23.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.167 -0.469 . . . . 72.32 110.926 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 16.3 m80 -93.41 62.52 3.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.122 -0.49 . . . . 72.34 110.854 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -57.82 -23.6 53.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 72.33 110.947 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.45 34.6 1.43 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.122 -0.49 . . . . 64.54 110.809 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -151.47 89.29 1.48 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 73.42 110.872 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.97 121.0 5.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.103 -0.499 . . . . 71.25 110.916 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 183' ' ' VAL . . . . . 0.838 HG11 HD22 ' A' ' 193' ' ' LEU . 16.7 m -51.74 163.79 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.445 . . . . 73.0 111.129 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -117.41 -36.77 3.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.15 110.849 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -162.58 -168.54 1.85 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 71.24 110.813 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.718 ' CZ ' HG22 ' A' ' 188' ' ' VAL . 0.2 OUTLIER -132.52 138.64 47.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 65.12 110.905 -179.929 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -74.59 116.43 15.27 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.539 1.149 . . . . 62.13 108.245 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 188' ' ' VAL . . . . . 0.718 HG22 ' CZ ' ' A' ' 186' ' ' TYR . 68.7 t -74.74 -38.47 44.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 114.972 -1.013 . . . . 63.21 111.083 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.98 -53.64 55.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 74.33 111.173 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -86.14 -10.36 54.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 71.22 110.859 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 34.2 t70 57.31 50.38 11.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 73.25 110.815 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -148.61 127.33 12.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 53.3 110.913 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.838 HD22 HG11 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -51.17 150.78 3.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.224 -0.444 . . . . 74.55 110.878 -179.958 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 194' ' ' ILE . . . . . 0.439 HG23 ' O ' ' A' ' 193' ' ' LEU . 1.0 OUTLIER -155.67 142.82 11.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.197 -0.456 . . . . 65.24 111.127 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 25.5 p -97.79 -175.02 3.05 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.488 1.118 . . . . 40.21 108.279 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.2 -33.73 67.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.934 -1.03 . . . . 63.51 111.079 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.22 -24.75 65.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.261 -0.427 . . . . 73.1 110.904 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 34.5 m -80.95 -31.69 34.82 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.499 1.124 . . . . 74.21 108.291 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 41.4 mtpt -77.16 -16.59 59.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.981 -1.009 . . . . 71.34 110.971 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.3 tp -105.48 -45.22 4.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.193 -0.458 . . . . 72.43 110.929 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 61.9 t -89.87 -42.69 14.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.451 . . . . 72.41 111.117 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -72.35 -147.37 0.71 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.706 -0.759 . . . . 70.25 112.484 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.0 21.74 6.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.838 0.352 . . . . 74.44 110.886 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -95.97 39.69 1.14 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.111 -0.495 . . . . 74.02 110.93 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -94.18 -40.89 9.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.237 -0.438 . . . . 74.23 110.901 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.37 7.15 46.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 60.13 110.792 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.8 m170 -83.19 -175.26 5.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.262 -0.426 . . . . 72.11 110.877 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -117.01 147.22 42.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 75.21 110.883 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 17.9 m -139.71 -173.21 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.452 . . . . 74.44 111.15 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -105.92 -169.43 1.58 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 72.25 111.098 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -154.84 144.88 21.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 74.23 111.058 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.97 169.85 9.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.446 . . . . 64.12 110.938 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 94.6 p -155.05 146.26 22.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 73.12 110.825 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 73.23 110.843 179.979 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 27.7 t . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.888 0.375 . . . . 75.31 110.885 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.3 135.65 55.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 71.21 110.856 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 4.3 pt -135.67 71.46 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 71.43 111.133 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 63.14 95.13 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.217 -0.447 . . . . 54.31 110.889 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 158.41 90.49 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.732 -0.747 . . . . 50.25 112.494 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.56 104.92 13.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.821 0.343 . . . . 74.23 110.926 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -52.08 154.96 2.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.46 . . . . 62.13 110.829 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.3 164.17 1.01 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.521 1.138 . . . . 73.41 108.33 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 6.4 mp -77.02 -48.03 19.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.98 -1.009 . . . . 64.11 110.918 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -84.17 -43.27 15.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 72.21 110.858 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . 0.484 ' CD2' HD13 ' A' ' 197' ' ' LEU . 20.7 m80 -89.77 62.11 5.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 75.21 110.869 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -52.24 -29.77 24.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.177 -0.465 . . . . 42.01 110.912 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -93.91 35.01 1.17 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 62.32 110.913 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.697 ' HG3' HD12 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -151.77 96.57 2.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 73.12 110.872 -179.851 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.48 126.38 27.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 73.1 110.902 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 183' ' ' VAL . . . . . 0.842 HG11 HD22 ' A' ' 193' ' ' LEU . 16.8 m -51.77 163.34 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.434 . . . . 74.43 111.102 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -118.96 -37.41 3.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 71.11 110.878 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.21 -168.45 2.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 73.15 110.831 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.748 ' CZ ' HG22 ' A' ' 188' ' ' VAL . 0.4 OUTLIER -132.71 138.69 47.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 72.21 110.947 -179.874 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.65 113.75 10.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.575 1.172 . . . . 64.2 108.359 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 188' ' ' VAL . . . . . 0.748 HG22 ' CZ ' ' A' ' 186' ' ' TYR . 60.5 t -74.21 -28.67 23.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.003 -0.998 . . . . 72.53 111.107 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.73 -56.34 16.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.453 . . . . 43.45 111.141 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.36 -4.59 55.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.246 -0.434 . . . . 72.41 110.843 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 6.2 t70 57.05 50.64 11.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 73.03 110.862 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.52 127.41 17.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 72.24 110.929 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.842 HD22 HG11 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -51.64 150.67 3.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.162 -0.472 . . . . 72.21 110.919 -179.981 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 194' ' ' ILE . . . . . 0.462 HG23 ' O ' ' A' ' 193' ' ' LEU . 1.0 OUTLIER -156.45 142.57 10.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 70.44 111.163 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 20.8 p -97.47 -175.1 3.1 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.434 1.084 . . . . 71.5 108.31 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.02 -35.9 69.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.971 -1.013 . . . . 60.4 111.081 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.697 HD12 ' HG3' ' A' ' 181' ' ' GLU . 0.2 OUTLIER -64.98 -24.71 67.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 61.12 110.883 -179.983 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 37.0 m -81.08 -32.39 33.97 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.422 1.076 . . . . 52.23 108.27 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 30.9 mtmt -76.45 -16.53 59.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.99 -1.005 . . . . 73.42 110.842 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.3 tp -105.74 -45.51 4.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 61.13 110.939 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' VAL . . . . . 0.627 ' CG2' HD23 ' A' ' 197' ' ' LEU . 53.0 t -89.73 -42.93 14.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.16 -0.473 . . . . 74.41 111.197 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -71.79 -149.2 0.76 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.743 -0.742 . . . . 53.45 112.462 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.52 20.7 6.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.808 0.337 . . . . 74.24 110.874 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -96.71 39.38 1.17 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 74.33 110.907 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.08 -47.94 6.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 41.24 110.882 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.76 2.03 39.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.223 -0.444 . . . . 75.32 110.891 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 36.3 m170 -79.98 -176.46 5.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 73.42 110.876 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.09 144.61 42.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.196 -0.456 . . . . 64.02 110.884 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.9 m -135.57 -175.23 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.205 -0.452 . . . . 72.44 111.124 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -107.91 79.98 1.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.097 -0.501 . . . . 75.02 111.038 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -93.78 119.73 33.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.281 -0.418 . . . . 53.13 111.074 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 59.15 -177.1 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 73.3 110.891 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -163.44 107.9 1.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 73.2 110.856 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.16 -0.473 . . . . 65.52 110.831 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 17.9 m . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.888 0.375 . . . . 44.21 110.836 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 59.3 m-70 -98.22 135.64 39.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 72.21 110.843 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 2.1 pt -133.25 37.4 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.444 . . . . 72.22 111.142 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.8 -27.53 30.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 73.31 110.853 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -59.47 124.39 36.27 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.809 -0.71 . . . . 72.44 112.521 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.33 98.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.901 0.382 . . . . 44.14 110.931 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.93 166.4 0.15 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 51.21 110.862 179.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -61.75 162.01 9.3 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.496 1.122 . . . . 60.33 108.271 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 3.9 mp -68.25 -53.1 26.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.98 -1.009 . . . . 72.33 110.94 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -84.27 -35.39 23.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 61.23 110.879 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . 0.522 ' NE2' HD22 ' A' ' 197' ' ' LEU . 32.4 m80 -91.98 71.03 5.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 70.13 110.884 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -24.36 67.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.203 -0.453 . . . . 71.05 110.914 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -95.44 34.73 1.41 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.481 . . . . 74.55 110.77 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.521 ' OE1' HD13 ' A' ' 197' ' ' LEU . 0.0 OUTLIER -140.1 -169.3 2.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 74.35 110.892 -179.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 9.7 tttt -140.71 127.61 20.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.485 . . . . 72.25 110.855 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 183' ' ' VAL . . . . . 0.787 HG11 HD22 ' A' ' 193' ' ' LEU . 3.3 m -50.61 167.81 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 70.0 111.081 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 39.6 t-20 -127.82 -38.08 1.89 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 73.43 110.856 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 1.2 mmt -164.17 -171.63 2.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 71.32 110.863 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.401 ' O ' HG12 ' A' ' 209' ' ' VAL . 51.3 t80 -117.07 126.93 53.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.216 -0.447 . . . . 71.21 110.954 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -83.43 107.06 15.68 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.45 1.094 . . . . 73.24 108.281 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 60.4 t -75.49 -41.27 42.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.011 -0.995 . . . . 64.13 111.1 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 189' ' ' THR . . . . . 0.544 HG23 ' OD2' ' A' ' 190' ' ' ASP . 1.2 t -50.49 -34.76 26.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.476 . . . . 71.34 111.079 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . 0.544 ' OD2' HG23 ' A' ' 189' ' ' THR . 1.1 m-20 -111.73 -9.44 14.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.266 -0.424 . . . . 54.52 110.827 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 9.2 t0 60.23 55.18 3.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 72.23 110.935 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -158.37 125.99 5.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.126 -0.488 . . . . 73.43 110.942 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.787 HD22 HG11 ' A' ' 183' ' ' VAL . 0.1 OUTLIER -57.1 149.18 19.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.457 . . . . 72.35 110.904 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 2.8 pp -150.32 -179.28 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 63.53 111.119 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 27.6 p -123.51 -175.51 3.22 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.509 1.131 . . . . 64.11 108.225 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -73.29 -32.28 64.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.983 -1.008 . . . . 61.11 111.06 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.522 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.3 OUTLIER -65.64 -25.5 67.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 74.32 110.951 -179.991 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 57.8 m -81.03 -35.45 31.86 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 124.568 1.168 . . . . 72.32 108.311 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 4.0 mtmt -76.91 -14.76 59.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.976 -1.011 . . . . 70.44 110.869 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.8 tp -105.38 -45.0 4.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.266 -0.425 . . . . 74.13 110.903 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 43.6 t -89.64 -43.0 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 62.21 111.122 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.94 -142.28 0.67 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.715 -0.755 . . . . 70.43 112.478 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -128.26 23.17 6.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.766 0.317 . . . . 72.44 110.896 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 -97.86 39.56 1.21 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.162 -0.472 . . . . 75.41 110.898 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -84.48 -40.51 17.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 71.2 110.859 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -97.95 7.05 46.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 65.3 110.905 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 207' ' ' HIS . . . . . 0.431 ' CG ' HG21 ' A' ' 189' ' ' THR . 39.3 m170 -80.5 120.48 24.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 74.14 110.813 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -59.64 163.66 4.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 73.03 110.913 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 209' ' ' VAL . . . . . 0.401 HG12 ' O ' ' A' ' 186' ' ' TYR . 14.0 m -149.11 -176.32 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 73.01 111.137 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -105.86 39.73 1.72 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.2 -0.455 . . . . 65.1 111.138 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -69.24 131.24 44.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 74.23 111.091 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 2.8 mp -74.6 170.81 15.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 74.21 110.947 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.3 p -100.78 175.59 5.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.211 -0.449 . . . . 53.31 110.855 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 72.54 110.916 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.941 0.4 . . . . 52.02 110.802 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . 0.535 ' C ' HD12 ' A' ' 170' ' ' ILE . 33.5 p80 -102.58 -28.55 12.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.067 -0.515 . . . . 74.32 110.824 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . 0.535 HD12 ' C ' ' A' ' 169' ' ' HIS . 1.9 mp 70.99 -70.41 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.439 . . . . 74.44 111.072 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -120.44 -50.68 2.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 72.21 110.877 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 134.2 166.99 11.4 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.748 -0.739 . . . . 65.41 112.452 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.614 ' O ' HG22 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -108.31 73.58 0.89 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.796 0.332 . . . . 73.32 110.926 -179.868 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.44 -169.48 1.47 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 74.13 110.888 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.32 161.59 16.28 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.499 1.124 . . . . 73.0 108.31 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.76 -53.26 34.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.008 -0.996 . . . . 75.31 110.946 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -84.62 -36.35 22.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 71.45 110.869 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 34.0 m80 -91.47 88.94 7.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 64.32 110.776 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -78.5 -25.46 45.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 63.43 110.86 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -95.5 34.58 1.44 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 74.5 110.896 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -141.3 179.57 6.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 75.32 110.908 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.14 128.34 41.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 73.34 110.88 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 183' ' ' VAL . . . . . 0.794 HG11 HD22 ' A' ' 193' ' ' LEU . 22.8 m -50.81 168.0 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.157 -0.474 . . . . 63.12 111.165 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -127.6 -38.49 1.9 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.258 -0.428 . . . . 63.42 110.893 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -164.52 -170.15 1.96 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 62.34 110.831 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -120.11 127.4 52.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 72.15 110.956 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -80.67 108.05 13.99 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.446 1.091 . . . . 53.34 108.268 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 188' ' ' VAL . . . . . . . . . . . . . 53.1 t -73.8 -28.49 24.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 114.955 -1.02 . . . . 63.34 111.191 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -55.6 28.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.133 -0.485 . . . . 73.11 111.191 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.5 -11.31 40.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 52.51 110.84 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 4.8 t70 63.51 55.05 1.82 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 75.43 110.889 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -157.39 125.12 5.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 72.52 110.88 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.794 HD22 HG11 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -52.86 148.87 6.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.24 -0.436 . . . . 65.35 110.864 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 194' ' ' ILE . . . . . . . . . . . . . 1.2 pp -147.24 -179.88 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 51.5 111.133 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 22.1 p -126.97 -175.67 3.49 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.465 1.103 . . . . 61.54 108.291 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -71.89 -34.68 69.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.992 -1.004 . . . . 53.54 111.123 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -23.69 67.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 64.12 110.942 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 51.7 m -80.97 -36.08 31.3 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.54 1.15 . . . . 73.41 108.317 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.74 -14.7 59.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.939 -1.028 . . . . 65.44 110.929 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.4 tp -105.19 -44.99 4.62 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.213 -0.448 . . . . 53.45 110.89 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 42.1 t -89.54 -43.08 14.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 71.42 111.104 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -75.71 -142.41 1.07 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.753 -0.737 . . . . 70.02 112.517 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 3.3 mtp85 -132.98 24.77 4.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.831 0.348 . . . . 74.55 110.827 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 50.1 m-70 -93.8 40.73 1.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 74.03 110.832 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 9.3 ptt85 -89.07 -39.74 13.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.277 -0.42 . . . . 71.25 110.875 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -94.8 3.8 54.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.199 -0.455 . . . . 73.1 110.851 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 48.5 m170 -79.95 120.18 23.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 74.3 110.855 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.84 143.89 50.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 62.22 110.891 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.7 m -139.69 -173.4 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.475 . . . . 55.41 111.089 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -123.46 113.53 18.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.231 -0.44 . . . . 30.42 111.097 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -71.68 152.96 42.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.273 -0.421 . . . . 65.22 111.066 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.26 142.19 45.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 64.53 110.878 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.5 p -165.27 133.89 3.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.116 -0.493 . . . . 52.11 110.852 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 63.4 110.925 -179.98 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 39.9 m . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.936 0.398 . . . . 71.31 110.859 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 33.8 p-80 -126.27 39.89 3.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 73.54 110.826 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 20.1 tt -115.88 -26.88 2.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.213 -0.448 . . . . 73.52 111.085 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 38.6 ttp85 -62.52 124.61 21.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 65.52 110.873 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -141.17 -167.75 11.22 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.765 -0.731 . . . . 60.11 112.524 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.664 ' O ' HG22 ' A' ' 183' ' ' VAL . 0.2 OUTLIER -108.34 102.29 11.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.851 0.358 . . . . 75.44 110.936 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.21 -171.57 1.86 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 65.42 110.861 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -95.05 160.98 14.32 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 75.01 108.267 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.25 -55.63 20.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.961 -1.018 . . . . 62.54 110.883 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -84.56 -33.63 23.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.429 . . . . 73.21 110.859 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . 0.615 ' NE2' HD22 ' A' ' 197' ' ' LEU . 28.2 m80 -94.96 65.85 2.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.476 . . . . 74.31 110.872 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.64 -28.48 67.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.435 . . . . 64.4 110.9 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -93.23 35.1 1.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 52.21 110.843 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.402 ' OE2' HD12 ' A' ' 197' ' ' LEU . 0.4 OUTLIER -135.54 175.31 9.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 72.41 110.883 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.63 113.55 13.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 72.51 110.92 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 183' ' ' VAL . . . . . 0.789 HG11 HD22 ' A' ' 193' ' ' LEU . 16.0 m -51.43 160.94 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.424 . . . . 61.5 111.151 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -122.87 -39.21 2.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 74.42 110.826 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . 0.405 ' O ' HD23 ' A' ' 193' ' ' LEU . 0.0 OUTLIER -156.26 -169.4 3.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.471 . . . . 53.54 110.845 179.971 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.623 ' CE1' HG22 ' A' ' 188' ' ' VAL . 0.3 OUTLIER -133.31 138.84 46.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.224 -0.444 . . . . 71.24 110.894 -179.864 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.66 114.79 12.31 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.495 1.122 . . . . 75.45 108.274 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 188' ' ' VAL . . . . . 0.623 HG22 ' CE1' ' A' ' 186' ' ' TYR . 20.7 t -74.29 -30.53 26.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 114.992 -1.004 . . . . 73.43 111.145 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.58 -56.08 21.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 73.55 111.18 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.59 -5.2 56.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.265 -0.425 . . . . 74.21 110.921 179.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 23.8 t70 56.59 50.08 13.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 70.13 110.893 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -143.81 127.32 16.94 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.143 -0.48 . . . . 74.23 110.916 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.789 HD22 HG11 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -51.33 151.02 3.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 73.44 110.944 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 194' ' ' ILE . . . . . 0.46 HG23 ' O ' ' A' ' 193' ' ' LEU . 1.0 OUTLIER -156.32 142.84 10.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 72.51 111.148 179.865 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.2 p -97.75 -175.19 3.1 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.524 1.14 . . . . 71.34 108.322 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.29 -32.69 66.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.0 -1.0 . . . . 33.11 111.118 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.615 HD22 ' NE2' ' A' ' 178' ' ' HIS . 0.2 OUTLIER -70.31 -22.2 62.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.26 -0.427 . . . . 71.34 110.858 -179.992 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 12.8 m -80.89 -33.6 34.16 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.446 1.091 . . . . 52.4 108.363 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -76.91 -15.6 59.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.977 -1.011 . . . . 74.12 110.9 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.9 tp -105.58 -45.15 4.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 73.24 110.879 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' VAL . . . . . 0.406 HG21 ' CD2' ' A' ' 197' ' ' LEU . 48.2 t -89.66 -42.8 14.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 53.55 111.207 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.48 -145.0 0.75 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.708 -0.758 . . . . 61.42 112.474 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -129.58 21.55 5.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.79 0.328 . . . . 74.33 110.907 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -99.28 39.86 1.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.244 -0.435 . . . . 51.42 110.864 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -94.24 -48.19 6.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 73.35 110.854 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -84.54 2.87 39.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.243 -0.435 . . . . 60.24 110.899 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 39.0 m170 -80.22 -176.75 5.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.461 . . . . 73.12 110.854 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -112.92 151.81 30.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 73.02 110.901 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.9 m -143.01 -175.88 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.462 . . . . 72.53 111.122 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -107.68 85.1 2.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 70.13 111.064 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -75.68 132.29 40.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 62.03 111.105 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.48 150.42 23.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 63.24 110.948 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 33.3 t -130.32 128.19 41.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.451 . . . . 70.3 110.848 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 70.41 110.891 179.985 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 66.4 m . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.86 0.362 . . . . 70.54 110.888 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -152.61 -54.79 0.12 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 74.2 110.871 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 5.3 pt -110.47 72.36 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.225 -0.443 . . . . 74.21 111.064 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -133.13 148.03 52.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.434 . . . . 72.23 110.817 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -96.47 64.9 1.08 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.787 -0.721 . . . . 73.45 112.498 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.5 115.93 3.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.752 0.311 . . . . 55.24 110.881 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -52.09 155.44 1.9 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.177 -0.465 . . . . 61.12 110.892 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 175' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.92 161.0 1.76 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.505 1.128 . . . . 73.4 108.332 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 10.5 mp -73.58 -47.92 36.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.048 -0.978 . . . . 70.12 110.906 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -84.21 -42.26 16.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.213 -0.448 . . . . 74.1 110.875 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . 0.72 ' CD2' HD22 ' A' ' 197' ' ' LEU . 24.0 m80 -91.89 62.11 4.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.078 -0.51 . . . . 72.34 110.828 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.44 -29.88 26.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 74.13 110.858 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -93.99 34.98 1.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.156 -0.475 . . . . 73.04 110.942 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.8 96.68 2.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.149 -0.478 . . . . 74.5 110.848 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -56.76 132.67 52.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 74.4 110.899 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 183' ' ' VAL . . . . . 0.854 HG11 HD22 ' A' ' 193' ' ' LEU . 20.0 m -61.3 165.73 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 71.14 111.149 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -119.65 -35.54 3.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 74.24 110.864 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -162.43 -168.27 1.8 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 70.02 110.934 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.748 ' CZ ' HG22 ' A' ' 188' ' ' VAL . 0.3 OUTLIER -132.6 138.51 47.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.289 -0.414 . . . . 62.31 110.931 -179.855 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 187' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.8 114.08 10.55 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.506 1.129 . . . . 51.02 108.278 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 188' ' ' VAL . . . . . 0.748 HG22 ' CZ ' ' A' ' 186' ' ' TYR . 60.1 t -74.32 -29.55 24.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 114.972 -1.013 . . . . 71.51 111.083 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -56.23 18.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 75.23 111.171 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -90.79 -5.1 56.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 61.35 110.895 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 3.7 t0 56.99 50.62 11.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 74.45 110.851 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -144.06 127.34 16.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 43.03 110.899 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.854 HD22 HG11 ' A' ' 183' ' ' VAL . 0.3 OUTLIER -51.58 150.27 3.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.243 -0.435 . . . . 71.35 110.882 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 194' ' ' ILE . . . . . 0.454 HG23 ' O ' ' A' ' 193' ' ' LEU . 1.0 OUTLIER -156.27 142.6 10.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.194 -0.457 . . . . 74.42 111.157 179.849 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 195' ' ' CYS . . . . . . . . . . . . . 28.5 p -95.8 -175.21 3.36 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 74.44 108.279 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -72.31 -32.72 66.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.993 -1.003 . . . . 63.0 111.096 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.72 HD22 ' CD2' ' A' ' 178' ' ' HIS . 0.1 OUTLIER -69.02 -24.04 64.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 72.43 110.859 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 198' ' ' CYS . . . . . . . . . . . . . 23.4 m -81.27 -31.32 33.73 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.514 1.134 . . . . 45.44 108.336 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 199' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -76.46 -17.54 59.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.002 -0.999 . . . . 65.14 110.873 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 3.9 tp -105.99 -45.88 4.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 72.22 110.922 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 44.6 t -89.81 -43.3 14.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.203 -0.453 . . . . 34.24 111.106 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -67.72 -153.8 0.42 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 74.45 112.551 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -120.08 19.29 12.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.818 0.342 . . . . 54.51 110.852 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -96.26 47.49 1.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 70.11 110.861 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.11 -51.16 4.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.23 -0.441 . . . . 73.43 110.843 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.9 7.2 31.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.881 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 207' ' ' HIS . . . . . . . . . . . . . 33.5 m170 -79.81 -176.41 5.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.47 . . . . 72.33 110.933 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -117.55 146.07 43.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 73.24 110.917 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 209' ' ' VAL . . . . . . . . . . . . . 18.9 m -136.17 -174.51 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 64.55 111.157 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -109.34 79.84 1.26 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.454 . . . . 63.32 111.069 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -70.23 140.5 52.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.22 -0.445 . . . . 25.4 111.08 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 212' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.59 153.42 27.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 75.54 110.967 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -158.91 107.75 1.91 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 72.24 110.823 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 62.21 110.863 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1175 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A 1187 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_