data_2mur_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 2mur _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.81 0.338 . . . . 0.0 111.077 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -151.97 143.39 23.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.876 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.1 ttp85 -102.1 -16.04 16.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.889 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -137.47 124.4 21.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.838 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.4 t -51.24 106.64 0.68 Allowed Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 121.581 0.705 . . . . 0.0 110.925 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.76 -3.92 12.98 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.611 2.207 . . . . 0.0 112.307 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -90.03 -55.1 3.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.829 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.3 p -112.13 19.53 17.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.871 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 42.93 63.06 1.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.945 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.3 ttpt -125.89 113.78 17.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.884 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -61.83 120.41 10.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.896 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -71.39 153.66 42.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.841 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.91 151.01 66.53 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.555 0.693 . . . . 0.0 111.128 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 170.57 16.31 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.671 2.247 . . . . 0.0 112.4 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 40.67 37.84 0.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.901 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.61 -175.98 6.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.964 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.6 p -132.29 162.32 31.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.167 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.44 -30.65 20.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.891 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.2 tp -72.11 -37.14 69.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.972 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.28 -59.89 4.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.837 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.7 t -54.6 -48.64 70.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.139 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 49.9 m-20 -60.25 -43.43 96.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.854 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.4 m -51.97 -47.56 64.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.848 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -75.43 -40.8 57.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 26.7 mt -57.78 -28.58 64.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.909 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.44 -51.09 18.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.092 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -68.45 -32.28 72.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.921 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 t -71.82 -49.25 40.21 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.476 1.11 . . . . 0.0 108.318 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.9 tp -52.35 -47.13 66.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.934 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.88 -38.52 79.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.049 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -73.84 -34.35 64.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.91 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.8 p -63.98 162.72 13.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.895 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 68.5 p -107.51 -24.72 11.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.194 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -104.16 125.7 50.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.861 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -94.21 59.54 2.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.881 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 32.8 m -74.33 149.97 7.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.119 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 51.4 m -98.05 112.21 24.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.143 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 36.8 p90 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.899 179.996 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 96.0 p . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.929 0.395 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -122.88 125.66 45.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.864 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 7.0 ptt? -101.49 155.47 18.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.908 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -103.66 154.86 19.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.903 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 42.0 pt -147.35 155.22 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.166 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -122.53 143.43 49.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.86 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 42.5 t -138.06 113.82 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.112 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -99.29 147.38 25.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.92 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 60.8 p -100.07 179.11 4.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.132 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 6.7 mp -73.2 -9.79 59.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.874 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 50.9 p -90.89 -12.59 35.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.106 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 106.56 -22.17 31.07 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.472 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -51.8 141.87 16.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.856 0.36 . . . . 0.0 110.915 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 6.5 m -118.95 117.5 28.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.136 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 51.2 mt -102.03 134.39 42.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.17 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 95.2 m -119.16 109.89 16.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.117 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 19.9 mt -133.66 170.11 16.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.895 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -110.88 148.45 32.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 19.6 m -145.57 161.52 12.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.132 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -104.56 160.9 24.48 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-O 121.709 0.766 . . . . 0.0 110.835 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 -23.21 30.89 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.635 2.223 . . . . 0.0 112.365 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 15.0 p -93.62 -10.05 35.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.843 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 -66.69 -175.82 0.43 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.884 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 37.9 p -133.21 165.37 24.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.126 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 31.6 mm -55.12 -48.45 76.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.17 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.97 -34.39 63.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.912 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -43.75 94.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.875 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 41.0 t -56.95 -32.61 39.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.146 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 26.2 mttt -78.95 -28.87 43.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.89 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.59 -51.6 68.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.082 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.06 -37.31 69.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.933 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 66.4 mt -61.22 -28.87 44.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.124 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -58.59 -43.49 89.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.921 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -70.98 -11.5 61.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.81 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -88.99 -66.41 0.92 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.933 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -81.85 -44.32 17.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.883 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.29 35.53 2.1 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.447 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -125.0 141.54 38.7 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.652 0.739 . . . . 0.0 111.1 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 143.53 50.98 Favored 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.652 2.235 . . . . 0.0 112.41 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 -12.81 33.67 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.714 2.276 . . . . 0.0 112.325 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -83.13 -1.59 53.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.84 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -122.09 -38.18 2.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.961 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -83.78 148.23 27.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.96 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 20.5 mmm-85 -132.44 176.82 8.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.874 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 17.5 mt -125.36 147.79 49.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.896 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 23.2 mm -134.94 122.2 36.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.097 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -157.76 144.48 17.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.894 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 62.86 27.97 16.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.072 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 62.88 28.75 72.38 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.514 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -136.53 151.98 50.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.797 0.332 . . . . 0.0 110.914 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -81.8 109.54 16.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.87 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 3.8 mt -83.0 124.41 30.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.931 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -141.38 178.14 7.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.74 -19.06 58.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.928 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -58.08 -20.15 41.19 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.471 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 10.7 mtt180 -137.72 167.74 21.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.923 0.392 . . . . 0.0 110.851 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 64.3 p -103.97 179.95 4.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.182 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -63.01 -47.78 81.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.915 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 40.5 t -62.17 -18.85 62.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.869 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -70.63 -36.57 73.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.926 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -100.61 15.73 27.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.902 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 9.3 t30 52.42 36.19 19.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.817 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 96.8 mt -75.43 101.92 2.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.081 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -91.55 -170.91 2.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.973 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 23.3 tttm -67.83 142.72 56.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.875 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 63.28 54.06 2.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 14.4 m -92.3 135.2 34.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.848 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -90.07 93.45 9.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.165 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 5.0 mp -106.38 159.54 16.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.92 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 5.1 m80 -112.87 169.59 8.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.848 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -121.35 128.89 52.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.967 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 45.9 t -133.05 121.06 42.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.09 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.71 119.29 38.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.962 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 19.8 mmm-85 -111.16 77.86 1.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.855 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 6.7 mt . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.944 -179.976 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.817 0.341 . . . . 0.0 111.086 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -143.28 139.05 29.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.935 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.78 8.54 28.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.855 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -155.32 124.2 6.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.898 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.2 t -51.8 107.75 0.9 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.573 0.701 . . . . 0.0 110.853 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 -1.1 7.9 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.652 2.235 . . . . 0.0 112.356 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -94.63 -54.3 3.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.869 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.6 p -114.78 21.58 14.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.903 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 42.55 69.09 0.41 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.97 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -125.85 105.42 8.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.937 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -57.17 112.02 1.24 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.859 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -67.47 153.29 44.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.949 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.08 151.52 34.33 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.546 0.689 . . . . 0.0 111.119 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.64 168.7 20.63 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.739 2.293 . . . . 0.0 112.386 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.4 ptt-85 39.7 40.34 0.65 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.863 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -83.79 -176.27 6.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.923 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.9 p -128.63 163.59 24.72 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.1 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -53.01 -31.77 42.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.87 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 13.4 tp -71.9 -32.01 66.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.942 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.24 -60.4 3.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.854 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 67.2 t -54.76 -37.81 41.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.119 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 -72.14 -38.99 69.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.862 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.6 m -51.39 -53.98 31.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.85 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -71.55 -43.66 65.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.898 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 13.3 mt -52.39 -29.63 25.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.918 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.05 -41.77 63.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.139 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -74.14 -40.48 62.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.978 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.1 t -57.83 -41.44 82.29 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.471 1.107 . . . . 0.0 108.323 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.3 mt -64.91 -58.82 5.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.89 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.03 -22.14 48.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.091 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -90.07 -24.18 21.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.862 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 t -102.07 165.0 11.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.848 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.7 t -124.92 1.25 8.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.073 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -71.1 -42.44 69.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.879 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.6 t0 61.08 53.97 3.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.914 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 16.7 t -77.4 151.87 5.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.147 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 55.4 m -123.49 118.5 27.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.112 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 40.8 p90 . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.973 179.899 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 68.7 m . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.925 0.393 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -126.16 122.91 37.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.87 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.5 ptt? -106.4 168.49 9.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.875 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -120.29 156.84 30.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.921 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 24.6 pt -146.39 155.21 12.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.132 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -119.44 117.47 28.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.94 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 66.9 t -106.42 122.06 59.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.092 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 2.3 ttmm -99.26 146.91 25.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.953 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 37.5 p -93.12 164.52 13.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.159 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 6.4 tp -61.94 -17.64 57.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.913 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.6 p -90.35 -12.72 36.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.15 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 109.65 -13.08 32.71 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.427 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 43.1 tttm -51.64 138.4 23.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.844 0.354 . . . . 0.0 110.865 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 24.8 m -105.35 124.3 49.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.146 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 72.5 mt -119.38 139.9 45.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.156 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 5.4 m -123.0 128.96 50.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.095 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 15.4 mt -149.78 170.33 18.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.856 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -108.38 151.91 25.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.896 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 6.4 m -148.62 175.06 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.076 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -125.6 160.99 53.21 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.706 0.765 . . . . 0.0 110.831 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 -26.57 27.3 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.678 2.252 . . . . 0.0 112.365 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.6 p -89.41 -15.89 32.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.861 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -63.51 -176.23 0.15 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.868 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 17.4 p -133.41 170.95 14.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.185 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 36.5 mm -60.5 -37.37 74.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.15 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -63.21 -33.16 74.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.911 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.88 -44.27 81.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.853 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 41.9 t -56.34 -36.95 48.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.143 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -78.58 -28.36 45.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.933 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.75 -51.67 67.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.097 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.89 -37.39 70.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.955 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 62.0 mt -59.31 -28.85 40.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.076 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -58.38 -43.74 88.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.89 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -70.23 -11.93 61.24 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.866 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -89.84 -66.07 0.96 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.869 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -80.7 -45.59 16.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.869 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.2 38.62 1.63 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.466 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -130.91 143.62 50.15 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.633 0.73 . . . . 0.0 111.12 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 142.93 49.2 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.715 2.276 . . . . 0.0 112.324 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 -12.35 32.66 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.686 2.258 . . . . 0.0 112.295 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -83.65 -0.75 51.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.83 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -121.88 -40.23 2.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.944 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -79.65 141.74 36.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.878 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -120.35 175.66 5.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.888 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 12.3 mt -129.22 147.58 51.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.921 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 17.6 mm -133.4 109.04 13.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.18 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -143.01 145.63 33.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.943 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 63.93 25.11 13.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.084 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 69.58 11.25 65.08 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.497 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 1.8 mtmt -125.61 152.02 45.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.694 0.283 . . . . 0.0 110.917 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -80.3 109.7 15.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.869 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 3.8 mt -76.12 141.87 41.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.891 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -147.81 170.61 17.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.909 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -60.83 -18.86 58.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.839 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.19 -17.38 45.37 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.535 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 15.3 mtt180 -133.62 167.58 20.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.911 0.386 . . . . 0.0 110.874 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 71.7 p -104.2 -179.91 4.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.119 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.62 -47.64 74.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 76.1 p -63.0 -23.86 67.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.886 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -68.72 -31.94 71.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.852 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -100.62 15.3 28.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.914 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 5.1 t30 51.14 32.11 7.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.895 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 83.0 mt -72.76 103.82 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.085 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 67.5 mm-40 -93.47 -169.73 2.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.94 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 22.1 tttt -66.21 144.99 56.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 63.43 50.02 3.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.5 t -87.27 122.49 31.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.896 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 1.4 m -90.68 113.81 25.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.124 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.3 163.94 23.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.919 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -107.95 170.02 8.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.875 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.56 121.33 37.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.896 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 17.6 t -124.11 109.93 24.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.07 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.44 125.97 34.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.867 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 4.7 mtp180 -111.08 84.94 2.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.904 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 5.3 mt . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.954 179.991 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.197 0 CA-C-O 120.811 0.339 . . . . 0.0 111.089 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -141.94 150.11 41.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.846 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.36 -10.12 16.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.906 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -146.19 127.56 14.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.898 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.4 t -51.16 106.67 0.68 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.577 0.704 . . . . 0.0 110.9 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 -2.22 9.74 Favored 'Trans proline' 0 N--CA 1.465 -0.196 0 C-N-CA 122.745 2.297 . . . . 0.0 112.431 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 5.9 mtm -93.42 -54.86 3.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.877 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 15.2 p -114.06 22.38 13.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.901 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 41.58 70.31 0.28 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.902 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.0 tppt? -128.08 106.7 9.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.833 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -60.7 115.13 3.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.897 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -70.99 153.8 42.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.847 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.59 151.97 68.61 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.596 0.712 . . . . 0.0 111.068 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.85 171.86 13.78 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.599 2.199 . . . . 0.0 112.286 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.79 37.87 0.39 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.893 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.99 -175.86 6.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.972 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 80.8 p -131.27 163.89 26.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.18 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -50.85 -31.84 18.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.863 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.1 tt -72.18 -38.86 69.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.883 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -57.77 -46.69 84.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.861 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.7 t -72.05 -54.62 16.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.091 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -52.99 -43.01 66.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.87 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.6 m -51.38 -49.19 62.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.829 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -73.66 -45.95 49.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.802 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.4 mt -54.27 -25.67 24.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.922 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.41 -51.33 17.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.117 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -70.52 -31.57 68.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.928 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 t -73.28 -35.35 66.13 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.512 1.133 . . . . 0.0 108.263 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 45.7 tp -62.14 -52.07 65.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.874 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -55.78 -36.35 67.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.064 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -82.88 -16.07 48.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.864 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.3 p -67.51 136.38 54.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.867 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 51.9 m -63.11 -52.67 61.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.2 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -117.16 129.29 55.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.953 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -74.46 74.3 1.92 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.878 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.2 p -76.64 151.76 5.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.136 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.2 m -99.68 110.87 23.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.149 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 39.2 p90 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.859 -179.972 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 4.6 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.984 0.421 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -88.64 116.09 26.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.946 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 10.9 ptt? -91.73 167.84 11.89 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.868 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -121.26 136.91 54.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.968 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 46.9 pt -124.85 155.18 33.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.126 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -116.03 115.92 26.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.838 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 98.8 t -96.94 110.34 24.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.101 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -99.29 112.14 24.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.881 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 15.5 p -64.24 169.41 4.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.217 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 27.6 tp -73.61 -8.09 54.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.885 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 30.7 p -93.9 -12.8 28.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.179 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 111.65 -15.64 26.67 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.447 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 19.2 tptt -51.49 139.86 19.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.78 0.324 . . . . 0.0 110.981 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 12.5 m -113.19 104.07 11.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.207 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 15.0 mt -100.04 141.78 16.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.151 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 25.9 m -120.34 107.98 13.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.106 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 38.1 mt -124.43 171.64 9.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.906 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -120.51 128.76 53.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 17.2 m -127.64 -179.61 2.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.101 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -131.01 161.18 63.19 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.614 0.721 . . . . 0.0 110.917 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 -10.73 29.29 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.699 2.266 . . . . 0.0 112.328 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 2.1 p -104.33 -22.01 13.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.871 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -59.17 -175.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.854 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 22.1 p -133.31 163.04 30.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.155 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 37.8 mm -56.18 -44.15 78.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.14 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -52.69 -33.89 49.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.841 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.9 -44.41 80.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.962 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 21.5 t -60.6 -27.87 41.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.147 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -78.97 -29.47 43.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.891 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -71.38 -30.79 66.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.172 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.5 -49.32 15.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.858 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 31.8 mt -53.87 -31.04 20.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.154 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -59.23 -36.83 76.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.887 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.84 -12.47 60.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.83 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -96.71 -65.86 0.94 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.924 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.96 -45.31 35.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.908 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.21 19.97 7.74 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.453 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -110.27 144.08 29.38 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.579 0.704 . . . . 0.0 111.124 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 144.27 53.41 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.655 2.237 . . . . 0.0 112.345 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -12.87 33.67 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.638 2.225 . . . . 0.0 112.283 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -82.79 -1.38 51.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.909 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -122.18 -37.72 2.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -84.95 140.94 30.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.912 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 15.1 mmt85 -122.81 179.88 4.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 11.7 mt -127.51 146.19 50.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.905 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 24.7 mm -136.9 129.94 45.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.141 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -169.24 146.16 3.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.878 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 64.79 24.29 12.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.115 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 65.67 28.8 73.97 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.472 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -141.57 154.37 45.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.742 0.306 . . . . 0.0 110.917 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -81.95 109.51 16.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.945 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 3.6 mt -80.67 125.34 29.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.885 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -139.32 178.84 6.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.9 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.19 -16.55 60.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.818 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.96 -16.88 49.49 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.482 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 16.9 mtt180 -139.71 167.76 21.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.942 0.401 . . . . 0.0 110.808 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 24.2 p -103.77 179.93 4.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.116 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.46 -47.88 80.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.95 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 77.8 p -62.96 -17.03 61.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.948 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -71.84 -35.89 70.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.846 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -100.62 14.93 29.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.936 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 21.5 t30 51.2 41.74 28.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.938 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 92.2 mt -80.87 104.99 10.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.131 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -93.92 -175.01 3.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.939 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 6.6 tttt -60.56 152.37 26.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.967 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 52.08 53.01 13.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.6 m -93.34 129.16 39.56 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.85 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 3.2 m -79.08 84.93 5.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.129 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 7.5 mt -96.98 124.96 41.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.879 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 14.2 m80 -89.57 168.43 12.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.898 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.5 tp -126.14 143.19 51.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.878 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 43.8 t -134.68 119.45 28.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.119 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.58 113.25 26.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.862 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 13.8 ttt-85 -111.31 77.85 1.07 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.811 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 2.0 mp . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.899 -179.959 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.792 0.33 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.29 164.58 20.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.907 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.3 -17.42 10.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.904 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 2.0 m -152.61 127.78 9.79 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.847 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.5 t -51.89 107.99 0.96 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.56 0.695 . . . . 0.0 110.892 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -2.87 10.94 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.605 2.203 . . . . 0.0 112.383 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtm -91.64 -54.32 3.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.931 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.8 p -113.29 20.39 16.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.928 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.08 61.13 2.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.915 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.8 ttpt -121.67 107.22 12.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -54.33 118.42 4.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.863 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -70.19 152.6 44.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.891 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.71 148.8 74.25 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.535 0.683 . . . . 0.0 111.088 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 168.96 20.05 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.649 2.233 . . . . 0.0 112.368 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.3 ptt180 39.59 40.5 0.63 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.925 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.72 -176.5 6.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.85 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.45 161.8 28.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.122 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -50.5 -36.27 33.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.8 tt -72.13 -38.95 69.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.911 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 83.2 m-20 -52.97 -50.74 63.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.868 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 19.4 t -66.25 -53.58 35.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.148 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -50.99 -32.77 22.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.873 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.5 m -59.45 -54.93 40.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.859 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -71.42 -34.73 70.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 mp -53.09 -47.1 68.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.867 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.24 -33.41 74.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.09 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -73.79 -31.65 63.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.936 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -76.25 -54.63 6.51 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.489 1.118 . . . . 0.0 108.301 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.2 tt -51.26 -57.67 8.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.888 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -55.46 -32.2 62.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.139 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -78.19 -21.78 49.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 92.5 p -93.92 175.23 6.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.877 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.9 m -124.86 4.37 8.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.186 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -101.32 151.3 22.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.847 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -105.31 57.3 0.68 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.854 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 10.2 p -77.16 149.93 6.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.091 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.9 m -117.0 114.22 23.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.131 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 36.8 p90 . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.96 179.922 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 46.4 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.915 0.388 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -133.94 126.16 29.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.851 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.6 ptt? -107.57 170.38 8.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.903 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -123.66 139.64 53.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.925 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 29.0 pt -127.97 170.68 17.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.116 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -128.91 138.59 52.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.844 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 58.1 t -118.52 111.54 34.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.093 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.52 117.15 33.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.882 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 11.1 p -73.15 172.72 10.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.13 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 15.2 mt -79.46 -1.61 38.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.967 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 14.6 t -90.12 -12.49 38.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.108 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 100.34 14.99 31.34 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.549 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -97.11 145.44 26.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.871 0.367 . . . . 0.0 110.96 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 2.6 m -109.44 137.0 47.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.227 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 62.7 mt -127.53 142.28 44.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.136 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 1.3 m -119.76 130.86 55.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.115 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 13.6 mt -149.33 171.3 16.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.934 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -110.07 147.99 32.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.904 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 11.1 m -148.66 179.69 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.127 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -141.88 160.94 53.98 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.589 0.709 . . . . 0.0 110.931 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 -12.8 33.67 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.701 2.267 . . . . 0.0 112.312 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.4 p -99.12 -22.78 15.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.867 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -62.12 -172.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.892 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 1.4 p -133.9 169.46 17.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.075 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 40.8 mm -61.91 -49.06 85.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.152 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -52.51 -35.61 53.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.906 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 125' ' ' ASN . . . . . 0.511 ' ND2' ' HZ3' ' B' ' 129' ' ' LYS . 0.1 OUTLIER -60.14 -50.31 74.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.887 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 22.9 t -56.47 -25.09 20.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.146 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -77.42 -27.67 52.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.893 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.22 -30.33 54.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.072 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.511 ' HZ3' ' ND2' ' B' ' 125' ' ' ASN . 0.1 OUTLIER -77.63 -29.03 51.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.83 -179.898 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 46.6 mt -77.39 -28.33 16.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.135 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -53.82 -48.23 70.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.885 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -68.81 -11.78 60.8 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.793 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 6.8 mptt -93.09 -66.07 0.95 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.928 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.16 -45.79 17.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.832 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.82 35.67 1.98 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.463 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -127.87 142.88 45.73 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.594 0.711 . . . . 0.0 111.131 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 145.64 57.42 Favored 'Trans proline' 0 C--O 1.231 0.132 0 C-N-CA 122.708 2.272 . . . . 0.0 112.302 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.78 -13.18 34.26 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.724 2.282 . . . . 0.0 112.324 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -82.8 -1.03 50.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.813 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -122.27 -38.12 2.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.924 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -83.72 153.88 23.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.913 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 19.0 mmt85 -138.33 179.64 6.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.9 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 21.2 mt -129.99 152.43 49.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.893 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 23.8 mm -137.24 118.31 17.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.13 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -155.6 146.89 22.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.879 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 65.41 23.41 11.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.063 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 66.01 29.36 74.84 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.466 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -143.0 154.8 44.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.799 0.333 . . . . 0.0 110.853 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -78.23 109.8 12.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.902 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 5.2 mt -77.25 133.75 38.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.863 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -154.67 173.16 16.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.949 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.89 -25.5 11.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.805 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -50.35 -28.36 13.93 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.51 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 13.9 mtt-85 -137.15 147.58 46.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.884 0.373 . . . . 0.0 110.92 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 30.2 p -82.66 -179.48 7.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.123 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.07 -47.52 82.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.882 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 27.9 p -59.53 -32.28 70.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.936 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -59.69 -30.86 69.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.843 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -100.61 11.74 38.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.929 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 10.4 t30 51.37 30.33 5.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.903 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 72.1 mt -68.98 110.45 2.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.16 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 61.0 mm-40 -93.34 -169.75 2.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.969 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 32.6 tttt -70.22 155.58 40.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.926 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 51.88 52.06 15.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.868 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.2 p -87.13 152.87 21.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.825 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.5 84.19 1.93 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.123 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 2.5 mt -94.42 140.58 29.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.957 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -93.09 155.57 17.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.867 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.64 117.49 31.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 90.6 t -121.98 127.65 75.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.176 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.21 119.81 40.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.886 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -111.26 77.85 1.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.839 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 16.6 mt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.917 179.981 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.816 0.341 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -143.18 137.62 29.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.935 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -102.24 -3.99 26.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.856 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -148.47 123.8 10.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.854 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.9 t -51.68 107.34 0.8 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.575 0.702 . . . . 0.0 110.955 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -2.9 10.94 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.684 2.256 . . . . 0.0 112.318 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 28.1 mtm -92.35 -55.07 3.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.928 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.3 p -110.59 18.2 19.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.881 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 43.79 61.25 2.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.946 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.4 ttpt -123.2 111.22 16.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.908 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -59.6 116.48 4.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.854 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -68.26 153.17 44.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.871 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.38 150.26 55.36 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.598 0.713 . . . . 0.0 111.059 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 169.21 19.4 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.665 2.243 . . . . 0.0 112.38 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.8 ptt85 39.94 39.66 0.62 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.897 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -83.8 -176.4 6.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.922 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.3 p -129.25 162.55 27.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.206 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -51.89 -34.27 40.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.892 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.26 -32.91 67.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.938 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -61.3 -55.79 27.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.839 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.4 t -64.89 -32.45 58.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.137 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -71.41 -34.21 70.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.828 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 75.6 m -61.39 -53.84 51.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.869 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -69.75 -40.52 76.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.859 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.4 mt -52.09 -50.02 62.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.901 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.97 -50.71 63.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.086 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -62.36 -52.05 65.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.921 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -38.93 64.97 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.526 1.141 . . . . 0.0 108.334 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.24 -58.34 8.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.907 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.75 -29.86 65.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.088 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -93.1 7.19 45.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.905 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 t -82.25 129.74 34.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.904 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 17.6 p -67.79 -24.44 65.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.105 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -139.64 128.09 22.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.855 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -81.36 83.35 6.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.872 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.8 m -99.22 173.28 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.128 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.1 m -122.3 128.17 50.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.19 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 41.2 p90 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.001 179.928 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.927 0.394 . . . . 0.0 110.868 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 6.7 p-80 -117.99 -175.35 2.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.833 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 7.4 ptt? -98.58 173.56 6.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.838 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -123.67 157.19 34.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.904 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 31.7 pt -143.49 163.28 16.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.109 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -123.18 115.88 22.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.871 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 44.7 t -104.87 120.04 54.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.128 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -112.24 140.43 46.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 43.9 p -94.61 -179.25 4.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.137 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 6.1 mp -78.1 -3.47 42.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.866 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 29.6 p -90.45 -1.74 57.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.183 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 92.69 -19.91 48.2 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.389 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 14.2 ttmm -61.16 139.32 58.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.835 0.35 . . . . 0.0 110.949 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 4.7 m -112.57 125.33 54.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.154 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 51.6 mt -110.0 142.47 22.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.151 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 29.1 m -124.15 107.56 11.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.189 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 11.6 mt -127.28 165.41 19.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.907 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -102.28 144.31 30.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.862 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 10.9 m -140.76 153.84 21.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.157 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -99.51 156.23 35.62 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.706 0.765 . . . . 0.0 110.907 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.82 -13.88 35.13 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.666 2.244 . . . . 0.0 112.341 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 84.3 p -105.07 -9.33 17.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.918 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -68.16 -174.6 0.51 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.867 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 24.2 p -132.45 175.18 9.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.175 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 32.7 mm -62.79 -46.84 95.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.091 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -53.94 -32.77 54.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.876 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.24 -43.13 82.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.914 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 42.6 t -56.18 -36.27 45.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.23 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 40.0 mttt -78.79 -28.65 44.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.869 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.74 -51.88 67.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.049 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.33 -37.95 71.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.912 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 57.3 mt -57.92 -29.18 35.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.136 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -57.27 -47.5 81.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.859 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -69.5 -11.49 60.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.828 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -88.72 -66.49 0.91 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.844 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -83.34 -45.32 13.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.858 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 111.28 41.77 1.13 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.445 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -133.82 142.15 42.56 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.61 0.719 . . . . 0.0 111.092 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 144.32 53.4 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.732 2.288 . . . . 0.0 112.297 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.84 -12.92 33.7 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.695 2.263 . . . . 0.0 112.269 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -83.0 -0.58 49.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.885 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -120.95 -38.4 2.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.87 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -83.62 154.2 23.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.972 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 41.5 mtt85 -135.53 174.78 10.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.839 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 6.7 tp -121.83 153.96 37.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.894 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 30.8 mm -139.62 108.33 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.094 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -144.87 146.28 31.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.859 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 64.07 23.4 13.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.099 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 72.73 6.07 65.99 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.488 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.6 155.52 36.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.72 0.295 . . . . 0.0 110.897 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -83.68 111.78 19.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.899 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 1.6 mt -79.16 135.63 36.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.915 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -139.88 177.58 7.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.884 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -63.24 -16.98 61.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.822 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.4 -17.29 46.65 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.483 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 8.4 mtt180 -136.85 167.51 21.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.827 0.346 . . . . 0.0 110.898 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 74.0 p -103.17 -179.7 4.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.073 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.37 -47.86 74.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.953 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 16.1 t -65.7 -18.27 65.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.838 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.23 -31.18 63.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.847 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -100.4 13.42 34.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.932 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 160' ' ' ASN . . . . . 0.422 ' ND2' HE22 ' B' ' 162' ' ' GLN . 17.0 t30 50.82 43.74 28.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.877 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 92.1 mt -82.22 108.3 15.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.135 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 162' ' ' GLN . . . . . 0.422 HE22 ' ND2' ' B' ' 160' ' ' ASN . 14.7 mp0 -89.34 178.51 6.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.894 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 30.5 tttm -64.84 150.93 46.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.884 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 59.49 34.85 22.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.96 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.8 m -75.9 135.23 40.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.88 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.51 110.15 22.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.059 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -121.75 155.54 35.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.882 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -103.18 151.16 22.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.829 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.4 tp -109.61 147.57 32.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.891 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 25.3 t -142.95 126.43 14.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.153 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -106.22 119.8 40.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.925 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.15 77.85 1.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.829 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 12.4 mt . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.898 -179.985 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.853 0.358 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -139.74 157.37 45.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.876 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -123.46 10.22 9.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.839 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.3 m -154.49 119.26 4.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.854 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 35.1 t -51.31 107.25 0.78 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.569 0.699 . . . . 0.0 110.879 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.77 -2.51 10.31 Favored 'Trans proline' 0 N--CA 1.465 -0.188 0 C-N-CA 122.693 2.262 . . . . 0.0 112.348 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.4 ttm -91.45 -53.76 4.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.875 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.3 p -116.08 21.55 13.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.898 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.04 67.54 0.62 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.939 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 tppt? -124.41 107.71 11.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.877 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -59.23 112.1 1.59 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.839 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -64.59 152.81 41.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.84 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -71.66 148.23 92.56 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.521 0.677 . . . . 0.0 111.114 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 167.97 22.95 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.626 2.217 . . . . 0.0 112.335 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 60.46 17.74 7.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.8 -174.9 3.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.949 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.2 p -139.8 169.9 16.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.181 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -52.2 -34.36 45.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.895 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 13.8 tp -72.19 -31.9 66.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.899 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.57 -60.54 3.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.872 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.0 t -57.15 -36.51 51.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.153 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -71.65 -41.01 69.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.876 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.5 m -51.54 -53.79 34.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.897 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -68.52 -49.98 55.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.893 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 12.6 mt -53.12 -25.54 13.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.874 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.08 -49.85 33.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.124 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -30.98 63.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.937 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.6 t -71.37 -23.08 61.83 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.454 1.096 . . . . 0.0 108.325 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 45.3 tp -84.93 -50.06 7.82 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.907 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.94 -15.9 63.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.071 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.32 -25.38 14.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.903 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 56.7 p -72.54 168.2 19.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.862 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.43 4.13 13.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.192 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -117.72 159.17 23.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.885 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -124.77 65.17 1.11 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.906 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 20.7 m -89.53 133.97 30.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.188 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.0 m -99.7 119.74 38.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.159 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 36.8 p90 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.909 179.954 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.899 0.38 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -116.33 114.31 24.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.893 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.7 ptt? -96.07 164.73 12.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.899 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -115.29 158.95 21.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.968 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 22.8 pt -149.76 155.25 8.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.122 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -121.95 141.25 51.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.934 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 93.1 t -131.58 113.58 23.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.161 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -99.26 132.91 44.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 68.0 p -87.44 175.75 7.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.099 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 13.6 mt -73.74 -10.3 59.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.902 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 24.4 p -90.38 -12.72 36.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.066 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 107.59 -14.72 38.65 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.464 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 2.9 ttmp? -51.8 148.29 5.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.966 0.412 . . . . 0.0 110.893 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 23.1 m -125.69 104.07 8.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.177 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 57.0 mt -96.93 141.99 14.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.146 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 90.6 m -130.05 108.83 10.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.21 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 13.8 mt -130.18 170.48 14.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.83 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -114.43 148.14 38.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.845 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 11.0 m -140.12 178.75 3.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.174 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -122.05 160.57 46.78 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.58 0.705 . . . . 0.0 110.886 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 -20.68 34.18 Favored 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.686 2.258 . . . . 0.0 112.299 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 57.4 m -96.83 -6.92 34.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.858 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -73.0 -175.78 1.88 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.918 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 5.2 p -135.07 164.34 27.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.189 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 38.2 mm -54.27 -38.8 40.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.149 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -60.77 -35.78 77.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.907 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.03 -41.88 94.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.857 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 23.9 t -56.74 -38.4 58.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.072 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -78.21 -28.94 48.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.76 -51.67 68.0 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.15 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.19 -39.23 68.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.935 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 55.9 mt -57.02 -29.58 31.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.146 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -56.39 -46.13 80.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.925 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -69.72 -11.69 61.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.81 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -89.61 -66.26 0.94 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.898 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -81.81 -45.49 15.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.898 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.69 37.34 1.74 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.533 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -129.37 142.22 44.49 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.631 0.729 . . . . 0.0 111.184 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 144.36 53.65 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.61 2.206 . . . . 0.0 112.35 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 -14.64 36.33 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.724 2.283 . . . . 0.0 112.312 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -81.57 -0.71 43.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.857 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -121.49 -37.59 2.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.961 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -85.43 155.02 21.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.913 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 45.5 mtt180 -139.06 -178.67 5.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.902 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 13.2 mt -130.0 153.98 47.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 22.0 mm -136.14 119.31 22.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.066 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -153.48 146.38 24.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.874 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 65.45 28.81 11.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.132 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 69.62 8.88 60.91 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.505 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.36 159.98 37.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.665 0.269 . . . . 0.0 110.926 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.87 128.44 34.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.87 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 5.1 mt -96.93 130.06 44.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.926 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -131.12 178.56 6.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.88 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.74 -16.86 59.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.918 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -55.28 -22.73 31.09 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.464 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 6.0 mtp85 -137.22 167.9 20.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.906 0.384 . . . . 0.0 110.821 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 64.1 p -99.19 -179.6 4.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.157 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -65.06 -44.61 88.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.907 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 11.0 p -67.46 -18.31 65.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.894 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -76.84 -30.92 56.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.915 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -100.74 15.97 26.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.937 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 13.2 t30 57.88 34.21 24.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.905 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 28.1 mm -68.93 109.08 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.183 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 81.1 mm-40 -101.24 173.47 6.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.955 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -61.02 140.38 57.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.868 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 58.63 48.93 11.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.879 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 3.3 m -82.96 137.92 34.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.872 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.67 96.63 8.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.148 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 6.0 mt -107.63 172.12 7.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.878 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 35.5 m-70 -132.39 170.06 15.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.846 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.57 119.11 30.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.952 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 23.6 t -125.36 114.81 41.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.119 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.76 119.36 38.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.94 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -111.13 77.96 1.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.861 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 9.0 mt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.848 -179.956 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.835 0.35 . . . . 0.0 111.082 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -134.29 129.83 36.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.893 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.45 4.45 52.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.9 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.5 m -154.53 126.63 7.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.934 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.2 t -52.14 108.23 1.03 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.693 0.759 . . . . 0.0 110.903 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.86 -0.73 7.42 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.623 2.215 . . . . 0.0 112.298 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -96.26 -54.04 3.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.868 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.9 p -114.39 22.23 13.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.916 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.5 tp60 41.46 68.18 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.866 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.1 tppt? -125.08 103.88 8.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.911 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -56.31 107.99 0.43 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.881 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -63.22 153.08 35.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.823 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.48 150.45 34.25 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.59 0.71 . . . . 0.0 111.067 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 168.6 21.22 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.642 2.228 . . . . 0.0 112.352 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 39.73 40.47 0.67 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.86 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.16 -176.49 6.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.9 p -129.46 164.4 23.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.107 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -52.35 -31.44 33.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.865 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.8 tp -71.92 -33.83 68.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.858 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.88 -59.51 4.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.871 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.7 t -57.59 -37.09 56.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.229 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -71.76 -36.29 70.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.878 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.6 m -54.92 -54.02 48.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.872 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -72.54 -43.12 63.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.87 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 13.5 mt -51.91 -31.81 30.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.883 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.34 -38.81 65.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.11 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -74.27 -45.58 46.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -53.1 -52.19 59.43 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.512 1.132 . . . . 0.0 108.271 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.0 mt -52.52 -56.21 16.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.911 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.94 -22.19 47.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.074 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -102.98 8.9 38.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.871 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.6 m -116.7 167.07 11.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.879 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.8 m -124.35 -33.54 3.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.142 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -51.16 -56.1 14.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.843 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 t0 63.72 54.49 1.82 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.899 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 29.4 m -81.64 165.11 2.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.128 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 6.1 m -115.01 117.07 29.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.095 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 33.5 p90 . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.972 179.93 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.864 0.364 . . . . 0.0 110.863 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -167.99 122.25 0.95 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.91 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.6 ptt? -100.69 170.73 8.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -119.84 141.72 49.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.934 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 42.1 pt -134.43 164.86 33.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.094 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -122.43 149.11 44.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.876 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 61.6 t -136.84 117.6 17.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.137 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.22 155.49 17.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.83 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 61.8 p -112.86 170.06 8.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.143 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 63.7 mt -64.83 -15.8 62.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.937 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 24.0 p -90.43 -12.55 37.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.091 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 104.22 -8.98 49.57 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.508 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 8.6 ttmm -51.75 142.39 14.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.912 0.387 . . . . 0.0 110.881 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 27.8 m -112.34 106.42 14.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.157 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 71.8 mt -100.68 141.79 16.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.207 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 31.6 m -129.25 122.62 30.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.187 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 12.8 mt -144.49 170.57 15.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.883 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -109.77 151.31 27.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.917 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 4.1 m -146.7 174.71 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.098 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -122.15 161.32 43.45 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.621 0.724 . . . . 0.0 110.873 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 -9.21 25.52 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.712 2.275 . . . . 0.0 112.315 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 13.0 m -103.5 -19.35 14.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.861 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -59.34 -174.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.876 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 59.2 p -142.13 172.87 12.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.105 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 28.1 mm -58.35 -35.52 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.167 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -74.7 -25.02 58.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.876 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -74.45 -50.37 18.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.868 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 2.4 p -56.59 -33.39 39.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.096 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -77.69 -28.46 51.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.945 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.49 -52.57 64.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.098 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.98 -30.69 67.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 47.5 mt -63.63 -29.37 47.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.082 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -58.15 -42.69 86.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.88 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -69.73 -11.44 60.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.872 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -90.92 -65.7 0.99 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.872 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -82.12 -45.48 15.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.911 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.3 42.35 1.18 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.472 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.78 143.1 41.3 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.688 0.756 . . . . 0.0 111.101 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 144.79 55.33 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.707 2.272 . . . . 0.0 112.342 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 -12.74 33.47 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.693 2.262 . . . . 0.0 112.365 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -83.53 -0.3 49.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.869 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -119.6 -39.42 2.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.966 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -80.29 147.74 31.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.927 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -121.74 -178.46 3.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.89 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 12.1 mt -136.39 147.98 47.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.918 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 17.2 mm -134.0 125.71 49.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.126 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -155.81 143.3 19.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.887 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 59.1 26.37 15.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.128 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 71.89 9.54 70.9 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.45 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.87 151.37 40.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.785 0.326 . . . . 0.0 110.877 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -82.92 109.96 17.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.959 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 4.5 mt -75.86 132.69 40.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.944 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -128.25 159.44 35.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.906 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -53.29 -26.7 19.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.886 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -52.05 -25.92 18.49 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.502 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -118.37 167.64 11.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.896 0.379 . . . . 0.0 110.925 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 65.0 p -110.57 -179.4 3.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.13 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -64.28 -41.1 97.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.942 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 38.2 t -67.25 -19.73 65.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.859 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -75.42 -35.88 60.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -100.47 8.44 43.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.958 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 10.2 t30 51.23 45.02 28.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.916 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 87.9 mt -78.98 105.31 8.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.098 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 64.7 mm-40 -89.62 -169.59 2.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.957 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 29.4 tttt -70.26 155.9 40.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.92 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 51.98 52.23 14.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.894 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.4 p -91.29 132.63 36.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.92 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 5.5 m -87.04 84.49 7.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.118 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 6.1 mt -97.92 134.71 40.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 56.5 m-70 -99.14 143.26 29.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.862 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.2 tt -103.61 140.85 37.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.89 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 11.4 t -138.57 111.17 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.08 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.95 119.6 27.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.919 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 12.6 tpp85 -111.64 77.37 1.04 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.831 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 8.0 mp . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.861 -179.991 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.871 0.367 . . . . 0.0 111.121 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -138.17 145.81 41.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.93 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.56 -1.54 21.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.842 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -154.29 123.25 6.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.886 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.9 t -51.24 106.58 0.67 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.594 0.711 . . . . 0.0 110.873 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.7 -3.8 12.71 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.703 2.269 . . . . 0.0 112.375 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.0 mtt -89.03 -54.82 3.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.86 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.0 p -113.91 19.49 16.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.955 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 44.44 67.19 0.72 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.853 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 tppt? -124.02 111.71 16.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.816 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -64.76 120.75 13.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.896 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -75.77 153.28 37.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.868 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.39 152.19 45.12 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.564 0.697 . . . . 0.0 111.074 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 170.3 16.82 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.678 2.252 . . . . 0.0 112.335 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.6 39.04 0.46 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.901 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.47 -179.12 7.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.864 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -125.76 163.95 21.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.078 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -51.29 -37.15 45.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.909 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.59 -40.06 70.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.922 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -53.6 -46.4 70.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.885 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.8 t -71.28 -55.84 12.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.113 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -51.43 -32.67 27.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.817 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.3 m -54.53 -54.63 38.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.84 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -70.15 -35.25 73.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.925 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.89 -44.47 70.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.907 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.51 -33.72 76.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.048 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -73.82 -53.1 11.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.935 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -53.49 -56.96 12.6 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.5 1.125 . . . . 0.0 108.327 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 24.8 tp -52.34 -48.79 65.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.998 -1.001 . . . . 0.0 110.909 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.09 -22.04 65.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.115 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -99.39 -2.52 36.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.896 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -112.05 157.13 21.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.856 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.0 p -107.83 4.22 25.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.159 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -110.44 103.94 12.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.91 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -80.0 62.88 4.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.801 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.5 p -77.93 145.28 10.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.106 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 33.0 m -99.74 111.0 23.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.143 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 38.3 p90 . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.895 -179.997 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 5.3 m . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.907 0.384 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -134.66 -81.09 0.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.906 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -172.13 155.83 3.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.847 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -109.18 147.41 32.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.989 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 44.4 pt -139.76 155.24 24.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.099 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -120.24 141.4 49.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.891 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 39.0 t -129.0 125.64 63.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.067 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.23 154.23 18.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.917 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 39.5 p -111.54 175.24 5.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.093 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 12.8 mt -71.55 -12.94 61.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.878 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 49.1 p -90.43 -12.62 36.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.156 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 102.7 -15.12 56.03 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.501 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 19.0 ttmt -51.74 155.22 1.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.885 0.374 . . . . 0.0 110.848 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 54.9 m -118.83 107.48 13.67 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.095 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 63.7 mt -97.11 141.89 14.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.142 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 11.6 m -129.2 131.2 47.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.161 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 17.8 mt -150.13 170.43 18.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.915 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -109.78 148.58 31.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.897 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 23.8 m -148.65 169.22 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.128 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -113.09 157.65 40.21 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.711 0.767 . . . . 0.0 110.825 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -10.39 28.38 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.667 2.245 . . . . 0.0 112.372 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 14.8 m -107.33 -13.05 15.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.834 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -63.86 -175.21 0.13 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.875 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 21.6 p -132.1 165.99 22.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.121 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 37.9 mm -57.51 -41.06 78.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.113 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -57.56 -33.23 67.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.872 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.52 -42.44 74.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.864 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 36.1 t -56.67 -35.52 45.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.147 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 34.3 mttm -78.56 -28.7 45.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.909 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.56 -51.88 66.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.064 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.57 -39.88 70.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.942 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 51.6 mt -53.68 -29.92 18.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.114 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -60.78 -41.49 95.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.925 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -68.81 -11.49 60.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.819 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.86 -66.12 0.94 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.905 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -80.5 -46.44 15.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.863 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.27 35.03 2.19 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.495 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -124.97 142.07 40.11 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.579 0.704 . . . . 0.0 111.107 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.86 144.59 53.98 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.619 2.213 . . . . 0.0 112.338 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 -13.06 34.11 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.705 2.27 . . . . 0.0 112.36 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -82.62 -1.45 51.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.896 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -122.25 -38.14 2.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.9 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -83.38 153.66 24.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.908 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 29.0 mtt-85 -137.03 179.56 6.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.852 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 13.0 mt -128.04 152.4 47.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.855 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 23.7 mm -138.61 111.14 6.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.095 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -146.35 145.43 30.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.854 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 63.93 24.37 13.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.083 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 68.68 28.35 73.2 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.467 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -143.99 154.3 43.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.791 0.329 . . . . 0.0 110.905 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -84.46 109.7 18.1 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.857 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 3.8 mt -81.31 131.39 35.29 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.919 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -137.99 -179.66 5.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.95 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.02 -16.57 60.28 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.829 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -58.87 -19.01 42.14 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.512 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 14.1 mtp85 -140.31 167.79 21.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.859 0.361 . . . . 0.0 110.882 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 41.4 p -101.2 -179.86 4.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.211 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -64.06 -47.61 79.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.944 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 8.5 p -65.48 -16.29 63.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.842 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.44 -32.54 58.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.824 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -100.7 16.05 26.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.895 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 8.2 t30 59.08 34.97 23.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.898 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 28.9 mm -68.61 104.22 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.151 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 65.8 mm-40 -96.42 175.63 6.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.895 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 38.1 tttt -60.5 141.82 56.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.883 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 63.99 35.95 10.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.858 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.5 m -67.68 128.95 38.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.814 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.26 96.31 9.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.145 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 4.9 mp -106.76 166.76 10.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.949 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -115.59 169.9 8.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.933 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.28 129.66 51.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.919 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 90.7 t -133.03 123.0 47.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.12 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.66 118.46 36.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.922 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -111.23 77.73 1.06 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.851 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 14.4 mt . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.884 -179.944 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 120.836 0.35 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -132.05 130.26 41.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.918 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -92.76 -2.46 55.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.841 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -154.41 127.28 8.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 32.4 t -51.85 107.59 0.87 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.609 0.719 . . . . 0.0 110.958 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -2.65 10.5 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.704 2.269 . . . . 0.0 112.327 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.67 -54.68 3.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.844 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.4 p -114.03 21.09 15.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.896 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 43.17 66.08 0.85 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.869 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.3 tppt? -122.51 106.69 11.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.894 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -59.29 120.72 9.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.933 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -76.83 153.24 35.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.892 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.69 154.06 68.02 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.579 0.704 . . . . 0.0 111.065 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.85 167.8 23.51 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.691 2.261 . . . . 0.0 112.287 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 39.96 40.11 0.69 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.84 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.0 -177.31 6.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.993 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.8 p -128.92 163.62 24.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.155 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.1 -36.77 51.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.927 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.3 tp -71.65 -32.18 67.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.925 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -62.68 -48.67 78.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.81 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.4 t -75.06 -38.72 43.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.13 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -65.07 -41.5 95.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.843 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.2 m -51.7 -53.91 34.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.841 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -70.45 -42.05 72.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.834 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -53.24 -33.54 53.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.898 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.69 -39.07 67.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.105 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -72.28 -48.89 39.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.08 -52.16 61.84 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.553 1.158 . . . . 0.0 108.33 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 23.6 tp -55.73 -45.85 77.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.9 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.06 -24.51 62.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.15 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -89.64 -34.69 16.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.898 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.2 t -96.99 113.01 24.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.936 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.0 t -63.52 -27.26 69.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.149 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -61.83 134.29 56.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.852 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -113.29 58.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.899 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 17.0 m -82.39 119.66 32.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.09 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.83 131.03 35.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.138 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 29.5 p90 . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.871 179.966 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.943 0.401 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -124.1 -174.61 3.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.871 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 7.9 ptt? -100.01 173.79 6.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.918 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -118.15 157.18 27.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.915 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 14.7 pt -145.06 166.47 11.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.075 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -124.45 152.97 42.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.885 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 62.1 t -134.74 132.27 54.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.116 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -108.69 136.46 48.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.945 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 2.3 p -99.3 164.1 12.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.167 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.9 mp -66.79 -13.88 62.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.893 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 5.1 t -90.2 -3.6 57.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.118 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 97.29 -27.55 18.03 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.471 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -52.49 140.22 23.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.814 0.34 . . . . 0.0 110.883 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 83.8 m -110.07 141.71 42.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.044 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 64.4 mt -125.36 141.99 43.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.164 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 13.9 m -125.69 110.33 13.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.15 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 11.6 mt -129.12 168.93 15.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -103.86 146.29 28.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.872 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 34.5 m -146.74 157.83 10.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.216 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 118' ' ' GLU . . . . . 0.408 ' HB3' ' HD2' ' B' ' 119' ' ' PRO . 8.0 mt-10 -100.83 155.6 36.14 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.622 0.725 . . . . 0.0 110.851 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 119' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' B' ' 118' ' ' GLU . 52.8 Cg_endo -69.78 -8.31 23.27 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.71 2.273 . . . . 0.0 112.326 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 3.6 m -109.56 -10.43 14.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.824 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -64.46 -174.03 0.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.854 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 22.9 p -130.55 176.52 8.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.101 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 39.5 mm -65.3 -50.89 70.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.159 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -57.51 -20.3 30.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.857 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.84 -51.24 23.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.944 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . 0.41 HG22 ' N ' ' B' ' 127' ' ' LYS . 3.5 m -56.44 -24.76 19.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.101 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 127' ' ' LYS . . . . . 0.41 ' N ' HG22 ' B' ' 126' ' ' VAL . 40.9 mttm -79.86 -31.79 40.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.892 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.59 -51.32 69.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.171 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -39.97 68.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.82 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 37.3 mt -58.06 -30.25 38.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.082 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -57.31 -45.13 84.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.901 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -71.97 -11.37 60.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.915 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.46 -66.13 0.93 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.895 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -85.07 -42.23 15.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.879 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.48 42.2 1.17 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.524 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -132.07 142.28 44.52 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.611 0.72 . . . . 0.0 111.089 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 143.84 52.06 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.68 2.253 . . . . 0.0 112.362 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 -12.68 33.41 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.624 2.216 . . . . 0.0 112.352 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -83.19 -1.07 52.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.91 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -121.86 -37.86 2.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.969 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -84.04 145.61 28.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.959 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 26.5 mmt85 -129.6 178.42 6.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.82 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 6.6 tp -121.51 151.68 40.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.935 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 30.8 mm -139.65 110.36 4.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.109 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -138.22 141.95 39.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.884 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 63.67 24.53 13.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.098 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 71.48 13.34 74.13 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.439 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -123.54 166.27 15.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.729 0.299 . . . . 0.0 110.933 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -92.25 123.7 35.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.921 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 2.2 mt -96.91 130.99 44.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.898 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -128.09 170.14 13.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.843 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -60.78 -19.22 58.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.843 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -56.47 -22.24 37.63 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.497 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 15.9 mtt-85 -128.36 166.65 18.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.896 0.379 . . . . 0.0 110.883 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 69.8 p -101.2 -179.71 4.12 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.122 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -64.97 -47.88 76.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.017 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 34.1 t -66.03 -15.72 63.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.815 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.79 -32.67 62.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.834 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -100.7 16.11 26.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.884 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 9.4 t30 59.17 34.64 23.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.882 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 77.9 mt -80.94 95.57 2.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.147 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -90.16 -169.5 2.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.982 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -62.55 150.09 41.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.88 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 51.18 55.83 8.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.895 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 2.3 m -89.86 132.47 35.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.873 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.49 94.35 9.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.087 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 2.8 mp -112.82 142.2 45.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.949 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -97.62 169.96 9.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.841 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 4.7 tp -120.9 143.04 49.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.878 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 26.0 t -132.93 112.71 18.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.146 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.77 114.79 29.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -111.33 77.89 1.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.878 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.904 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.826 0.346 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.09 133.38 42.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.919 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.66 2.04 49.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.917 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -154.26 125.55 7.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.818 -179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.6 t -51.98 108.02 0.97 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.679 0.752 . . . . 0.0 110.94 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -2.63 10.53 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.632 2.221 . . . . 0.0 112.346 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 15.6 mtm -93.08 -54.49 3.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.892 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.9 p -112.63 21.09 15.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.9 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 42.08 63.38 1.37 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.893 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -122.02 105.72 10.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.888 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -57.08 112.66 1.42 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.869 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -66.27 153.56 42.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.861 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.91 152.74 47.75 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.564 0.697 . . . . 0.0 111.136 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 168.1 22.54 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.684 2.256 . . . . 0.0 112.325 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.57 40.69 0.65 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.817 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.41 -176.89 6.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.998 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.1 p -129.31 162.24 28.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.166 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 21.8 mm100 -51.09 -36.23 39.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.882 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.0 tp -71.85 -34.27 69.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.916 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -60.09 -50.56 73.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.856 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.7 t -71.09 -30.27 40.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.134 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -71.21 -43.2 67.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.823 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.4 m -51.67 -53.98 33.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.893 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -68.26 -44.89 74.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.833 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.5 mt -52.47 -36.57 55.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.905 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.32 -41.68 96.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.125 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -74.06 -50.0 21.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.903 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.28 -42.23 69.79 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.473 1.108 . . . . 0.0 108.24 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 23.1 tp -64.66 -49.71 69.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.954 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.82 -23.1 64.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.066 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -93.71 -21.45 19.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.885 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.1 t -70.47 153.69 42.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.872 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -105.82 -17.68 14.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.192 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -114.18 132.75 55.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.887 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -88.97 70.34 8.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.884 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.7 m -81.84 127.09 39.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.159 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.1 m -90.32 118.25 29.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.18 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 33.4 p90 . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.887 -179.977 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 49.7 p . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.865 0.364 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -164.95 126.31 2.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.856 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 10.3 ptt? -106.51 172.45 6.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.938 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -127.76 159.68 34.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.924 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 41.5 pt -142.92 162.68 17.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.107 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -126.91 119.23 26.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.85 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 21.9 t -108.31 118.52 56.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.137 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.08 126.54 43.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.898 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 79.0 p -64.42 173.68 1.99 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.145 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.6 tp -79.95 -1.16 38.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.935 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.7 t -105.93 -12.9 15.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.142 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 120.55 -25.45 7.28 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.453 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -48.68 138.63 10.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.809 0.338 . . . . 0.0 110.916 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 90.6 m -108.77 119.63 40.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.215 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 62.3 mt -109.11 142.41 21.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.111 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 19.8 m -128.0 125.74 39.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.135 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 13.2 mt -146.99 159.48 43.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -96.79 140.68 31.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.875 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 34.0 m -144.43 156.58 14.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.126 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -103.95 161.61 22.43 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.623 0.725 . . . . 0.0 110.903 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 -24.43 29.64 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.716 2.278 . . . . 0.0 112.353 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 56.9 p -90.28 -12.35 38.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.828 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -61.57 -174.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.899 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 33.8 p -137.25 162.16 34.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.21 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 41.8 mm -55.07 -34.72 32.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.159 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -72.39 -20.49 61.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -75.93 -52.78 9.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.925 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 3.8 m -56.8 -28.23 27.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.165 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 9.6 mmtt -78.6 -29.62 46.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.923 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.47 -51.78 68.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.046 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.77 -39.63 73.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.927 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 40.9 mt -54.88 -31.3 24.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.163 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -57.44 -43.19 83.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.899 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -72.67 -12.39 61.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.868 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -88.14 -64.39 1.15 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.941 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.91 -44.83 16.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.899 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.32 39.65 1.48 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.459 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -135.29 147.75 63.45 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.613 0.72 . . . . 0.0 111.152 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 143.03 49.75 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.667 2.245 . . . . 0.0 112.367 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.68 -9.98 27.49 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.725 2.284 . . . . 0.0 112.369 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -83.6 -0.19 49.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.863 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -120.85 -39.29 2.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.869 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -83.67 147.94 27.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.9 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 82.8 mtt180 -138.82 172.12 13.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 5.9 mt -114.06 153.58 29.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.887 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 23.5 mm -137.45 103.25 2.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.179 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -138.47 147.52 43.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.883 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 67.56 24.03 8.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.091 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 70.64 8.39 63.24 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.458 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.69 163.75 16.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.762 0.315 . . . . 0.0 110.916 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -89.1 109.83 20.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.896 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 3.6 mt -77.63 129.65 35.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.864 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -138.04 172.74 12.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.906 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -60.02 -19.21 51.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.87 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -57.27 -21.38 39.85 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.458 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 11.5 mtp180 -131.43 167.75 18.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.926 0.393 . . . . 0.0 110.865 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 39.8 p -101.66 179.92 4.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.174 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.87 -48.09 72.71 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.9 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 43.0 t -64.83 -20.59 66.48 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.856 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.2 -31.25 68.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.808 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -100.78 13.54 34.6 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.882 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 14.5 t30 50.81 44.58 27.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.878 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 92.3 mt -83.03 111.15 18.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.167 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 -93.79 -176.2 3.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.858 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 36.0 tttt -69.43 145.37 52.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.912 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 62.91 36.94 12.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.94 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 2.3 m -72.83 139.36 46.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.875 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.09 107.22 19.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.153 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 1.1 mp -126.5 172.85 9.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.91 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -121.59 169.6 10.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.863 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.05 127.89 55.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.897 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 16.1 t -125.53 114.21 38.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.09 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -101.46 119.47 38.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.91 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 -111.06 96.46 6.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.892 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 1.5 mm? . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.906 -179.973 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 37.7 m . . . . . 0 C--O 1.233 0.189 0 CA-C-O 120.92 0.39 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -104.74 43.17 1.12 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.82 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 4.4 mtt -93.92 159.27 15.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.876 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 152.05 -128.63 2.58 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.545 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 63.88 44.9 4.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.816 0.341 . . . . 0.0 111.047 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.23 155.33 1.89 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.063 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -84.55 -9.67 58.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.077 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -151.97 143.39 23.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.876 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.1 ttp85 -102.1 -16.04 16.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.889 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -137.47 124.4 21.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.838 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.4 t -51.24 106.64 0.68 Allowed Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 121.581 0.705 . . . . 0.0 110.925 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.76 -3.92 12.98 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.611 2.207 . . . . 0.0 112.307 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -90.03 -55.1 3.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.829 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.3 p -112.13 19.53 17.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.871 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 42.93 63.06 1.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.945 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.3 ttpt -125.89 113.78 17.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.884 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -61.83 120.41 10.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.896 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -71.39 153.66 42.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.841 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.91 151.01 66.53 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.555 0.693 . . . . 0.0 111.128 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 170.57 16.31 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.671 2.247 . . . . 0.0 112.4 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 40.67 37.84 0.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.901 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.61 -175.98 6.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.964 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.6 p -132.29 162.32 31.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.167 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.44 -30.65 20.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.891 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.2 tp -72.11 -37.14 69.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.972 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.28 -59.89 4.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.837 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.7 t -54.6 -48.64 70.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.139 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 49.9 m-20 -60.25 -43.43 96.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.854 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.4 m -51.97 -47.56 64.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.848 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -75.43 -40.8 57.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 26.7 mt -57.78 -28.58 64.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.909 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.44 -51.09 18.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.092 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -68.45 -32.28 72.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.921 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 t -71.82 -49.25 40.21 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.476 1.11 . . . . 0.0 108.318 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.9 tp -52.35 -47.13 66.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.934 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.88 -38.52 79.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.049 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -73.84 -34.35 64.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.91 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.8 p -63.98 162.72 13.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.895 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 68.5 p -107.51 -24.72 11.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.194 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -104.16 125.7 50.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.861 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -94.21 59.54 2.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.881 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 32.8 m -74.33 149.97 7.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.119 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 51.4 m -98.05 112.21 24.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.143 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 36.8 p90 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.899 179.996 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 96.0 p . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.929 0.395 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -122.88 125.66 45.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.864 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 7.0 ptt? -101.49 155.47 18.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.908 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -103.66 154.86 19.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.903 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 42.0 pt -147.35 155.22 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.166 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -122.53 143.43 49.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.86 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 42.5 t -138.06 113.82 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.112 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -99.29 147.38 25.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.92 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 60.8 p -100.07 179.11 4.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.132 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 6.7 mp -73.2 -9.79 59.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.874 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 50.9 p -90.89 -12.59 35.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.106 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 106.56 -22.17 31.07 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.472 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -51.8 141.87 16.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.856 0.36 . . . . 0.0 110.915 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 6.5 m -118.95 117.5 28.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.136 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 51.2 mt -102.03 134.39 42.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.17 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 95.2 m -119.16 109.89 16.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.117 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 19.9 mt -133.66 170.11 16.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.895 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -110.88 148.45 32.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 19.6 m -145.57 161.52 12.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.132 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -104.56 160.9 24.48 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-O 121.709 0.766 . . . . 0.0 110.835 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 -23.21 30.89 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.635 2.223 . . . . 0.0 112.365 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 15.0 p -93.62 -10.05 35.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.843 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 -66.69 -175.82 0.43 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.884 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 37.9 p -133.21 165.37 24.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.126 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 31.6 mm -55.12 -48.45 76.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.17 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.97 -34.39 63.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.912 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -43.75 94.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.875 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 41.0 t -56.95 -32.61 39.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.146 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 26.2 mttt -78.95 -28.87 43.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.89 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.59 -51.6 68.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.082 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.06 -37.31 69.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.933 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 66.4 mt -61.22 -28.87 44.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.124 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -58.59 -43.49 89.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.921 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -70.98 -11.5 61.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.81 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -88.99 -66.41 0.92 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.933 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -81.85 -44.32 17.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.883 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.29 35.53 2.1 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.447 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -125.0 141.54 38.7 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.652 0.739 . . . . 0.0 111.1 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 143.53 50.98 Favored 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.652 2.235 . . . . 0.0 112.41 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 -12.81 33.67 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.714 2.276 . . . . 0.0 112.325 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -83.13 -1.59 53.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.84 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -122.09 -38.18 2.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.961 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -83.78 148.23 27.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.96 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 20.5 mmm-85 -132.44 176.82 8.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.874 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 17.5 mt -125.36 147.79 49.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.896 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 23.2 mm -134.94 122.2 36.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.097 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -157.76 144.48 17.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.894 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 62.86 27.97 16.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.072 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 62.88 28.75 72.38 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.514 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -136.53 151.98 50.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.797 0.332 . . . . 0.0 110.914 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -81.8 109.54 16.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.87 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 3.8 mt -83.0 124.41 30.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.931 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -141.38 178.14 7.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.74 -19.06 58.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.928 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -58.08 -20.15 41.19 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.471 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 10.7 mtt180 -137.72 167.74 21.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.923 0.392 . . . . 0.0 110.851 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 64.3 p -103.97 179.95 4.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.182 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -63.01 -47.78 81.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.915 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 40.5 t -62.17 -18.85 62.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.869 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -70.63 -36.57 73.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.926 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -100.61 15.73 27.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.902 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 9.3 t30 52.42 36.19 19.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.817 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 96.8 mt -75.43 101.92 2.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.081 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -91.55 -170.91 2.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.973 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 23.3 tttm -67.83 142.72 56.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.875 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 63.28 54.06 2.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 14.4 m -92.3 135.2 34.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.848 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -90.07 93.45 9.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.165 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 5.0 mp -106.38 159.54 16.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.92 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 5.1 m80 -112.87 169.59 8.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.848 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -121.35 128.89 52.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.967 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 45.9 t -133.05 121.06 42.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.09 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.71 119.29 38.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.962 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 19.8 mmm-85 -111.16 77.86 1.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.855 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 6.7 mt -51.67 141.36 16.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.944 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -91.24 -60.93 1.77 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.859 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -89.62 -30.52 13.26 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.546 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.531 -179.951 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.9 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.909 0.385 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 29.3 p80 -155.71 154.73 31.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.9 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.4 ttt -79.47 114.94 18.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.867 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.88 45.49 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.473 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -127.61 54.46 1.68 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.763 0.316 . . . . 0.0 111.106 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -171.69 164.11 6.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.043 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -90.7 -25.24 20.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.086 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -143.28 139.05 29.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.935 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.78 8.54 28.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.855 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -155.32 124.2 6.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.898 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.2 t -51.8 107.75 0.9 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.573 0.701 . . . . 0.0 110.853 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 -1.1 7.9 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.652 2.235 . . . . 0.0 112.356 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -94.63 -54.3 3.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.869 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.6 p -114.78 21.58 14.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.903 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 42.55 69.09 0.41 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.97 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -125.85 105.42 8.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.937 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -57.17 112.02 1.24 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.859 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -67.47 153.29 44.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.949 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.08 151.52 34.33 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.546 0.689 . . . . 0.0 111.119 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.64 168.7 20.63 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.739 2.293 . . . . 0.0 112.386 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.4 ptt-85 39.7 40.34 0.65 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.863 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -83.79 -176.27 6.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.923 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.9 p -128.63 163.59 24.72 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.1 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -53.01 -31.77 42.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.87 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 13.4 tp -71.9 -32.01 66.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.942 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.24 -60.4 3.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.854 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 67.2 t -54.76 -37.81 41.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.119 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 -72.14 -38.99 69.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.862 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.6 m -51.39 -53.98 31.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.85 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -71.55 -43.66 65.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.898 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 13.3 mt -52.39 -29.63 25.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.918 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.05 -41.77 63.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.139 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -74.14 -40.48 62.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.978 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.1 t -57.83 -41.44 82.29 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.471 1.107 . . . . 0.0 108.323 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.3 mt -64.91 -58.82 5.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.89 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.03 -22.14 48.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.091 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -90.07 -24.18 21.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.862 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 t -102.07 165.0 11.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.848 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.7 t -124.92 1.25 8.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.073 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -71.1 -42.44 69.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.879 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.6 t0 61.08 53.97 3.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.914 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 16.7 t -77.4 151.87 5.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.147 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 55.4 m -123.49 118.5 27.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.112 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 40.8 p90 . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.973 179.899 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 68.7 m . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.925 0.393 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -126.16 122.91 37.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.87 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.5 ptt? -106.4 168.49 9.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.875 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -120.29 156.84 30.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.921 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 24.6 pt -146.39 155.21 12.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.132 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -119.44 117.47 28.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.94 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 66.9 t -106.42 122.06 59.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.092 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 2.3 ttmm -99.26 146.91 25.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.953 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 37.5 p -93.12 164.52 13.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.159 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 6.4 tp -61.94 -17.64 57.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.913 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.6 p -90.35 -12.72 36.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.15 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 109.65 -13.08 32.71 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.427 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 43.1 tttm -51.64 138.4 23.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.844 0.354 . . . . 0.0 110.865 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 24.8 m -105.35 124.3 49.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.146 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 72.5 mt -119.38 139.9 45.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.156 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 5.4 m -123.0 128.96 50.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.095 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 15.4 mt -149.78 170.33 18.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.856 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -108.38 151.91 25.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.896 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 6.4 m -148.62 175.06 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.076 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -125.6 160.99 53.21 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.706 0.765 . . . . 0.0 110.831 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 -26.57 27.3 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.678 2.252 . . . . 0.0 112.365 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.6 p -89.41 -15.89 32.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.861 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -63.51 -176.23 0.15 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.868 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 17.4 p -133.41 170.95 14.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.185 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 36.5 mm -60.5 -37.37 74.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.15 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -63.21 -33.16 74.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.911 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.88 -44.27 81.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.853 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 41.9 t -56.34 -36.95 48.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.143 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -78.58 -28.36 45.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.933 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.75 -51.67 67.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.097 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.89 -37.39 70.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.955 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 62.0 mt -59.31 -28.85 40.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.076 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -58.38 -43.74 88.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.89 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -70.23 -11.93 61.24 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.866 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -89.84 -66.07 0.96 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.869 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -80.7 -45.59 16.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.869 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.2 38.62 1.63 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.466 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -130.91 143.62 50.15 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.633 0.73 . . . . 0.0 111.12 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 142.93 49.2 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.715 2.276 . . . . 0.0 112.324 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 -12.35 32.66 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.686 2.258 . . . . 0.0 112.295 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -83.65 -0.75 51.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.83 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -121.88 -40.23 2.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.944 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -79.65 141.74 36.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.878 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -120.35 175.66 5.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.888 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 12.3 mt -129.22 147.58 51.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.921 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 17.6 mm -133.4 109.04 13.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.18 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -143.01 145.63 33.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.943 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 63.93 25.11 13.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.084 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 69.58 11.25 65.08 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.497 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 1.8 mtmt -125.61 152.02 45.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.694 0.283 . . . . 0.0 110.917 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -80.3 109.7 15.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.869 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 3.8 mt -76.12 141.87 41.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.891 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -147.81 170.61 17.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.909 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -60.83 -18.86 58.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.839 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.19 -17.38 45.37 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.535 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 15.3 mtt180 -133.62 167.58 20.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.911 0.386 . . . . 0.0 110.874 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 71.7 p -104.2 -179.91 4.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.119 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.62 -47.64 74.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 76.1 p -63.0 -23.86 67.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.886 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -68.72 -31.94 71.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.852 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -100.62 15.3 28.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.914 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 5.1 t30 51.14 32.11 7.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.895 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 83.0 mt -72.76 103.82 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.085 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 67.5 mm-40 -93.47 -169.73 2.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.94 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 22.1 tttt -66.21 144.99 56.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 63.43 50.02 3.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.5 t -87.27 122.49 31.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.896 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 1.4 m -90.68 113.81 25.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.124 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.3 163.94 23.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.919 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -107.95 170.02 8.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.875 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.56 121.33 37.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.896 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 17.6 t -124.11 109.93 24.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.07 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.44 125.97 34.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.867 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 4.7 mtp180 -111.08 84.94 2.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.904 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 5.3 mt -67.46 -22.81 65.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.954 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 63.61 39.33 8.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.898 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 167.77 -99.83 0.16 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.529 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.434 -179.982 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.867 0.365 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 61.0 m170 -112.49 171.45 7.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.848 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -157.72 163.2 38.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.838 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 110.63 45.19 0.92 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.521 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -108.97 31.95 5.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.802 0.334 . . . . 0.0 111.108 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -159.09 -175.25 5.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.151 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -88.98 -23.47 22.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.089 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -141.94 150.11 41.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.846 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.36 -10.12 16.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.906 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -146.19 127.56 14.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.898 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.4 t -51.16 106.67 0.68 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.577 0.704 . . . . 0.0 110.9 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 -2.22 9.74 Favored 'Trans proline' 0 N--CA 1.465 -0.196 0 C-N-CA 122.745 2.297 . . . . 0.0 112.431 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 5.9 mtm -93.42 -54.86 3.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.877 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 15.2 p -114.06 22.38 13.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.901 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 41.58 70.31 0.28 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.902 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.0 tppt? -128.08 106.7 9.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.833 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -60.7 115.13 3.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.897 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -70.99 153.8 42.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.847 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.59 151.97 68.61 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.596 0.712 . . . . 0.0 111.068 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.85 171.86 13.78 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.599 2.199 . . . . 0.0 112.286 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.79 37.87 0.39 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.893 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.99 -175.86 6.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.972 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 80.8 p -131.27 163.89 26.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.18 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -50.85 -31.84 18.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.863 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.1 tt -72.18 -38.86 69.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.883 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -57.77 -46.69 84.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.861 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.7 t -72.05 -54.62 16.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.091 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -52.99 -43.01 66.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.87 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.6 m -51.38 -49.19 62.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.829 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -73.66 -45.95 49.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.802 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.4 mt -54.27 -25.67 24.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.922 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.41 -51.33 17.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.117 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -70.52 -31.57 68.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.928 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 t -73.28 -35.35 66.13 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.512 1.133 . . . . 0.0 108.263 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 45.7 tp -62.14 -52.07 65.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.874 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -55.78 -36.35 67.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.064 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -82.88 -16.07 48.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.864 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.3 p -67.51 136.38 54.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.867 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 51.9 m -63.11 -52.67 61.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.2 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -117.16 129.29 55.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.953 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -74.46 74.3 1.92 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.878 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.2 p -76.64 151.76 5.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.136 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.2 m -99.68 110.87 23.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.149 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 39.2 p90 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.859 -179.972 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 4.6 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.984 0.421 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -88.64 116.09 26.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.946 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 10.9 ptt? -91.73 167.84 11.89 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.868 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -121.26 136.91 54.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.968 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 46.9 pt -124.85 155.18 33.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.126 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -116.03 115.92 26.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.838 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 98.8 t -96.94 110.34 24.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.101 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -99.29 112.14 24.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.881 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 15.5 p -64.24 169.41 4.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.217 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 27.6 tp -73.61 -8.09 54.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.885 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 30.7 p -93.9 -12.8 28.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.179 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 111.65 -15.64 26.67 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.447 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 19.2 tptt -51.49 139.86 19.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.78 0.324 . . . . 0.0 110.981 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 12.5 m -113.19 104.07 11.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.207 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 15.0 mt -100.04 141.78 16.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.151 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 25.9 m -120.34 107.98 13.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.106 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 38.1 mt -124.43 171.64 9.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.906 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -120.51 128.76 53.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 17.2 m -127.64 -179.61 2.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.101 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -131.01 161.18 63.19 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.614 0.721 . . . . 0.0 110.917 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 -10.73 29.29 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.699 2.266 . . . . 0.0 112.328 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 2.1 p -104.33 -22.01 13.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.871 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -59.17 -175.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.854 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 22.1 p -133.31 163.04 30.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.155 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 37.8 mm -56.18 -44.15 78.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.14 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -52.69 -33.89 49.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.841 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.9 -44.41 80.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.962 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 21.5 t -60.6 -27.87 41.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.147 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -78.97 -29.47 43.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.891 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -71.38 -30.79 66.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.172 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.5 -49.32 15.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.858 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 31.8 mt -53.87 -31.04 20.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.154 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -59.23 -36.83 76.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.887 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.84 -12.47 60.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.83 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -96.71 -65.86 0.94 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.924 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.96 -45.31 35.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.908 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.21 19.97 7.74 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.453 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -110.27 144.08 29.38 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.579 0.704 . . . . 0.0 111.124 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 144.27 53.41 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.655 2.237 . . . . 0.0 112.345 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -12.87 33.67 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.638 2.225 . . . . 0.0 112.283 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -82.79 -1.38 51.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.909 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -122.18 -37.72 2.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -84.95 140.94 30.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.912 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 15.1 mmt85 -122.81 179.88 4.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 11.7 mt -127.51 146.19 50.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.905 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 24.7 mm -136.9 129.94 45.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.141 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -169.24 146.16 3.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.878 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 64.79 24.29 12.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.115 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 65.67 28.8 73.97 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.472 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -141.57 154.37 45.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.742 0.306 . . . . 0.0 110.917 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -81.95 109.51 16.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.945 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 3.6 mt -80.67 125.34 29.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.885 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -139.32 178.84 6.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.9 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.19 -16.55 60.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.818 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.96 -16.88 49.49 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.482 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 16.9 mtt180 -139.71 167.76 21.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.942 0.401 . . . . 0.0 110.808 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 24.2 p -103.77 179.93 4.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.116 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.46 -47.88 80.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.95 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 77.8 p -62.96 -17.03 61.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.948 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -71.84 -35.89 70.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.846 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -100.62 14.93 29.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.936 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 21.5 t30 51.2 41.74 28.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.938 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 92.2 mt -80.87 104.99 10.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.131 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -93.92 -175.01 3.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.939 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 6.6 tttt -60.56 152.37 26.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.967 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 52.08 53.01 13.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.6 m -93.34 129.16 39.56 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.85 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 3.2 m -79.08 84.93 5.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.129 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 7.5 mt -96.98 124.96 41.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.879 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 14.2 m80 -89.57 168.43 12.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.898 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.5 tp -126.14 143.19 51.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.878 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 43.8 t -134.68 119.45 28.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.119 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.58 113.25 26.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.862 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 13.8 ttt-85 -111.31 77.85 1.07 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.811 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 2.0 mp -51.83 142.69 14.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.899 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 19.3 mmt180 -72.26 170.99 12.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.853 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -79.29 66.22 3.49 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.485 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.545 -179.976 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.0 p . . . . . 0 C--O 1.233 0.208 0 CA-C-O 120.789 0.328 . . . . 0.0 110.839 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -93.95 112.2 24.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.834 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 36.4 mtm -102.75 156.24 17.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.875 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -127.12 -102.35 1.2 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.524 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.03 111.41 3.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.8 0.333 . . . . 0.0 111.12 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -172.53 -176.03 1.46 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.091 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.67 -44.87 0.54 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.135 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.29 164.58 20.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.907 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.3 -17.42 10.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.904 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 2.0 m -152.61 127.78 9.79 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.847 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.5 t -51.89 107.99 0.96 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.56 0.695 . . . . 0.0 110.892 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -2.87 10.94 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.605 2.203 . . . . 0.0 112.383 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtm -91.64 -54.32 3.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.931 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.8 p -113.29 20.39 16.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.928 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.08 61.13 2.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.915 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.8 ttpt -121.67 107.22 12.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -54.33 118.42 4.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.863 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -70.19 152.6 44.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.891 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.71 148.8 74.25 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.535 0.683 . . . . 0.0 111.088 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 168.96 20.05 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.649 2.233 . . . . 0.0 112.368 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.3 ptt180 39.59 40.5 0.63 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.925 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.72 -176.5 6.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.85 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.45 161.8 28.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.122 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -50.5 -36.27 33.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.8 tt -72.13 -38.95 69.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.911 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 83.2 m-20 -52.97 -50.74 63.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.868 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 19.4 t -66.25 -53.58 35.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.148 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -50.99 -32.77 22.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.873 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.5 m -59.45 -54.93 40.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.859 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -71.42 -34.73 70.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 mp -53.09 -47.1 68.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.867 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.24 -33.41 74.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.09 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -73.79 -31.65 63.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.936 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -76.25 -54.63 6.51 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.489 1.118 . . . . 0.0 108.301 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.2 tt -51.26 -57.67 8.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.888 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -55.46 -32.2 62.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.139 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -78.19 -21.78 49.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 92.5 p -93.92 175.23 6.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.877 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.9 m -124.86 4.37 8.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.186 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -101.32 151.3 22.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.847 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -105.31 57.3 0.68 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.854 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 10.2 p -77.16 149.93 6.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.091 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.9 m -117.0 114.22 23.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.131 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 36.8 p90 . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.96 179.922 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 46.4 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.915 0.388 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -133.94 126.16 29.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.851 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.6 ptt? -107.57 170.38 8.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.903 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -123.66 139.64 53.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.925 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 29.0 pt -127.97 170.68 17.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.116 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -128.91 138.59 52.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.844 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 58.1 t -118.52 111.54 34.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.093 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.52 117.15 33.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.882 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 11.1 p -73.15 172.72 10.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.13 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 15.2 mt -79.46 -1.61 38.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.967 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 14.6 t -90.12 -12.49 38.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.108 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 100.34 14.99 31.34 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.549 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -97.11 145.44 26.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.871 0.367 . . . . 0.0 110.96 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 2.6 m -109.44 137.0 47.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.227 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 62.7 mt -127.53 142.28 44.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.136 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 1.3 m -119.76 130.86 55.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.115 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 13.6 mt -149.33 171.3 16.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.934 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -110.07 147.99 32.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.904 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 11.1 m -148.66 179.69 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.127 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -141.88 160.94 53.98 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.589 0.709 . . . . 0.0 110.931 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 -12.8 33.67 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.701 2.267 . . . . 0.0 112.312 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.4 p -99.12 -22.78 15.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.867 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -62.12 -172.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.892 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 1.4 p -133.9 169.46 17.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.075 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 40.8 mm -61.91 -49.06 85.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.152 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -52.51 -35.61 53.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.906 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 125' ' ' ASN . . . . . 0.511 ' ND2' ' HZ3' ' B' ' 129' ' ' LYS . 0.1 OUTLIER -60.14 -50.31 74.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.887 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 22.9 t -56.47 -25.09 20.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.146 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -77.42 -27.67 52.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.893 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.22 -30.33 54.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.072 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.511 ' HZ3' ' ND2' ' B' ' 125' ' ' ASN . 0.1 OUTLIER -77.63 -29.03 51.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.83 -179.898 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 46.6 mt -77.39 -28.33 16.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.135 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -53.82 -48.23 70.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.885 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -68.81 -11.78 60.8 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.793 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 6.8 mptt -93.09 -66.07 0.95 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.928 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.16 -45.79 17.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.832 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.82 35.67 1.98 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.463 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -127.87 142.88 45.73 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.594 0.711 . . . . 0.0 111.131 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 145.64 57.42 Favored 'Trans proline' 0 C--O 1.231 0.132 0 C-N-CA 122.708 2.272 . . . . 0.0 112.302 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.78 -13.18 34.26 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.724 2.282 . . . . 0.0 112.324 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -82.8 -1.03 50.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.813 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -122.27 -38.12 2.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.924 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -83.72 153.88 23.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.913 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 19.0 mmt85 -138.33 179.64 6.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.9 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 21.2 mt -129.99 152.43 49.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.893 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 23.8 mm -137.24 118.31 17.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.13 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -155.6 146.89 22.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.879 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 65.41 23.41 11.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.063 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 66.01 29.36 74.84 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.466 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -143.0 154.8 44.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.799 0.333 . . . . 0.0 110.853 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -78.23 109.8 12.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.902 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 5.2 mt -77.25 133.75 38.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.863 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -154.67 173.16 16.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.949 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.89 -25.5 11.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.805 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -50.35 -28.36 13.93 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.51 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 13.9 mtt-85 -137.15 147.58 46.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.884 0.373 . . . . 0.0 110.92 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 30.2 p -82.66 -179.48 7.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.123 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.07 -47.52 82.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.882 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 27.9 p -59.53 -32.28 70.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.936 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -59.69 -30.86 69.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.843 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -100.61 11.74 38.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.929 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 10.4 t30 51.37 30.33 5.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.903 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 72.1 mt -68.98 110.45 2.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.16 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 61.0 mm-40 -93.34 -169.75 2.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.969 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 32.6 tttt -70.22 155.58 40.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.926 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 51.88 52.06 15.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.868 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.2 p -87.13 152.87 21.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.825 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.5 84.19 1.93 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.123 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 2.5 mt -94.42 140.58 29.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.957 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -93.09 155.57 17.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.867 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.64 117.49 31.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 90.6 t -121.98 127.65 75.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.176 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.21 119.81 40.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.886 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -111.26 77.85 1.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.839 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 16.6 mt -52.76 171.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.917 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -123.0 51.45 1.43 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.879 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -162.21 -50.95 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.535 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.298 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.447 -179.935 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.5 p . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.927 0.394 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -131.9 26.19 4.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.878 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.6 mpt? -129.58 37.83 3.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.94 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -51.57 109.36 0.79 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.536 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -125.53 -175.31 3.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.786 0.327 . . . . 0.0 111.111 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.18 -168.89 1.64 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.069 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -83.39 -4.65 58.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.105 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -143.18 137.62 29.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.935 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -102.24 -3.99 26.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.856 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -148.47 123.8 10.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.854 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.9 t -51.68 107.34 0.8 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.575 0.702 . . . . 0.0 110.955 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -2.9 10.94 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.684 2.256 . . . . 0.0 112.318 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 28.1 mtm -92.35 -55.07 3.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.928 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.3 p -110.59 18.2 19.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.881 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 43.79 61.25 2.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.946 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.4 ttpt -123.2 111.22 16.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.908 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -59.6 116.48 4.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.854 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -68.26 153.17 44.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.871 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.38 150.26 55.36 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.598 0.713 . . . . 0.0 111.059 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 169.21 19.4 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.665 2.243 . . . . 0.0 112.38 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.8 ptt85 39.94 39.66 0.62 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.897 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -83.8 -176.4 6.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.922 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.3 p -129.25 162.55 27.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.206 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -51.89 -34.27 40.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.892 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.26 -32.91 67.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.938 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -61.3 -55.79 27.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.839 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.4 t -64.89 -32.45 58.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.137 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -71.41 -34.21 70.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.828 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 75.6 m -61.39 -53.84 51.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.869 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -69.75 -40.52 76.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.859 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.4 mt -52.09 -50.02 62.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.901 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.97 -50.71 63.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.086 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -62.36 -52.05 65.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.921 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -38.93 64.97 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.526 1.141 . . . . 0.0 108.334 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.24 -58.34 8.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.907 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.75 -29.86 65.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.088 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -93.1 7.19 45.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.905 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 t -82.25 129.74 34.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.904 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 17.6 p -67.79 -24.44 65.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.105 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -139.64 128.09 22.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.855 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -81.36 83.35 6.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.872 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.8 m -99.22 173.28 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.128 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.1 m -122.3 128.17 50.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.19 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 41.2 p90 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.001 179.928 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.927 0.394 . . . . 0.0 110.868 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 6.7 p-80 -117.99 -175.35 2.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.833 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 7.4 ptt? -98.58 173.56 6.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.838 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -123.67 157.19 34.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.904 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 31.7 pt -143.49 163.28 16.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.109 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -123.18 115.88 22.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.871 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 44.7 t -104.87 120.04 54.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.128 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -112.24 140.43 46.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 43.9 p -94.61 -179.25 4.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.137 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 6.1 mp -78.1 -3.47 42.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.866 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 29.6 p -90.45 -1.74 57.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.183 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 92.69 -19.91 48.2 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.389 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 14.2 ttmm -61.16 139.32 58.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.835 0.35 . . . . 0.0 110.949 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 4.7 m -112.57 125.33 54.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.154 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 51.6 mt -110.0 142.47 22.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.151 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 29.1 m -124.15 107.56 11.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.189 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 11.6 mt -127.28 165.41 19.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.907 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -102.28 144.31 30.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.862 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 10.9 m -140.76 153.84 21.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.157 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -99.51 156.23 35.62 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.706 0.765 . . . . 0.0 110.907 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.82 -13.88 35.13 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.666 2.244 . . . . 0.0 112.341 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 84.3 p -105.07 -9.33 17.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.918 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -68.16 -174.6 0.51 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.867 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 24.2 p -132.45 175.18 9.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.175 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 32.7 mm -62.79 -46.84 95.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.091 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -53.94 -32.77 54.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.876 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.24 -43.13 82.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.914 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 42.6 t -56.18 -36.27 45.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.23 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 40.0 mttt -78.79 -28.65 44.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.869 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.74 -51.88 67.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.049 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.33 -37.95 71.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.912 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 57.3 mt -57.92 -29.18 35.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.136 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -57.27 -47.5 81.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.859 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -69.5 -11.49 60.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.828 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -88.72 -66.49 0.91 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.844 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -83.34 -45.32 13.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.858 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 111.28 41.77 1.13 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.445 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -133.82 142.15 42.56 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.61 0.719 . . . . 0.0 111.092 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 144.32 53.4 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.732 2.288 . . . . 0.0 112.297 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.84 -12.92 33.7 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.695 2.263 . . . . 0.0 112.269 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -83.0 -0.58 49.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.885 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -120.95 -38.4 2.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.87 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -83.62 154.2 23.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.972 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 41.5 mtt85 -135.53 174.78 10.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.839 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 6.7 tp -121.83 153.96 37.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.894 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 30.8 mm -139.62 108.33 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.094 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -144.87 146.28 31.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.859 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 64.07 23.4 13.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.099 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 72.73 6.07 65.99 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.488 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.6 155.52 36.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.72 0.295 . . . . 0.0 110.897 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -83.68 111.78 19.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.899 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 1.6 mt -79.16 135.63 36.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.915 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -139.88 177.58 7.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.884 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -63.24 -16.98 61.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.822 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.4 -17.29 46.65 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.483 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 8.4 mtt180 -136.85 167.51 21.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.827 0.346 . . . . 0.0 110.898 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 74.0 p -103.17 -179.7 4.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.073 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.37 -47.86 74.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.953 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 16.1 t -65.7 -18.27 65.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.838 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.23 -31.18 63.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.847 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -100.4 13.42 34.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.932 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 160' ' ' ASN . . . . . 0.422 ' ND2' HE22 ' B' ' 162' ' ' GLN . 17.0 t30 50.82 43.74 28.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.877 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 92.1 mt -82.22 108.3 15.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.135 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 162' ' ' GLN . . . . . 0.422 HE22 ' ND2' ' B' ' 160' ' ' ASN . 14.7 mp0 -89.34 178.51 6.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.894 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 30.5 tttm -64.84 150.93 46.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.884 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 59.49 34.85 22.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.96 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.8 m -75.9 135.23 40.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.88 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.51 110.15 22.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.059 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -121.75 155.54 35.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.882 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -103.18 151.16 22.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.829 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.4 tp -109.61 147.57 32.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.891 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 25.3 t -142.95 126.43 14.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.153 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -106.22 119.8 40.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.925 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.15 77.85 1.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.829 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 12.4 mt -52.28 126.81 20.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.898 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 18.9 ttt180 -109.51 114.3 27.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.934 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 109.03 -60.77 0.32 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.47 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.46 -179.914 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.6 p . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.902 0.382 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -130.36 106.63 8.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.876 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 12.8 mtt -114.25 -75.11 0.6 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.87 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 157.58 -139.18 6.23 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.479 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -131.51 112.69 12.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.719 0.295 . . . . 0.0 111.112 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.1 115.43 0.15 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.098 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.53 -21.5 62.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.063 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -139.74 157.37 45.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.876 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -123.46 10.22 9.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.839 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.3 m -154.49 119.26 4.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.854 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 35.1 t -51.31 107.25 0.78 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.569 0.699 . . . . 0.0 110.879 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.77 -2.51 10.31 Favored 'Trans proline' 0 N--CA 1.465 -0.188 0 C-N-CA 122.693 2.262 . . . . 0.0 112.348 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.4 ttm -91.45 -53.76 4.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.875 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.3 p -116.08 21.55 13.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.898 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.04 67.54 0.62 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.939 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 tppt? -124.41 107.71 11.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.877 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -59.23 112.1 1.59 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.839 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -64.59 152.81 41.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.84 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -71.66 148.23 92.56 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.521 0.677 . . . . 0.0 111.114 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 167.97 22.95 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.626 2.217 . . . . 0.0 112.335 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 60.46 17.74 7.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.8 -174.9 3.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.949 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.2 p -139.8 169.9 16.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.181 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -52.2 -34.36 45.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.895 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 13.8 tp -72.19 -31.9 66.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.899 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.57 -60.54 3.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.872 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.0 t -57.15 -36.51 51.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.153 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -71.65 -41.01 69.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.876 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.5 m -51.54 -53.79 34.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.897 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -68.52 -49.98 55.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.893 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 12.6 mt -53.12 -25.54 13.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.874 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.08 -49.85 33.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.124 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -30.98 63.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.937 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.6 t -71.37 -23.08 61.83 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.454 1.096 . . . . 0.0 108.325 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 45.3 tp -84.93 -50.06 7.82 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.907 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.94 -15.9 63.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.071 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.32 -25.38 14.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.903 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 56.7 p -72.54 168.2 19.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.862 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.43 4.13 13.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.192 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -117.72 159.17 23.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.885 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -124.77 65.17 1.11 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.906 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 20.7 m -89.53 133.97 30.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.188 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.0 m -99.7 119.74 38.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.159 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 36.8 p90 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.909 179.954 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.899 0.38 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -116.33 114.31 24.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.893 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.7 ptt? -96.07 164.73 12.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.899 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -115.29 158.95 21.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.968 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 22.8 pt -149.76 155.25 8.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.122 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -121.95 141.25 51.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.934 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 93.1 t -131.58 113.58 23.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.161 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -99.26 132.91 44.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 68.0 p -87.44 175.75 7.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.099 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 13.6 mt -73.74 -10.3 59.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.902 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 24.4 p -90.38 -12.72 36.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.066 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 107.59 -14.72 38.65 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.464 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 2.9 ttmp? -51.8 148.29 5.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.966 0.412 . . . . 0.0 110.893 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 23.1 m -125.69 104.07 8.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.177 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 57.0 mt -96.93 141.99 14.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.146 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 90.6 m -130.05 108.83 10.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.21 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 13.8 mt -130.18 170.48 14.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.83 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -114.43 148.14 38.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.845 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 11.0 m -140.12 178.75 3.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.174 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -122.05 160.57 46.78 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.58 0.705 . . . . 0.0 110.886 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 -20.68 34.18 Favored 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.686 2.258 . . . . 0.0 112.299 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 57.4 m -96.83 -6.92 34.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.858 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -73.0 -175.78 1.88 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.918 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 5.2 p -135.07 164.34 27.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.189 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 38.2 mm -54.27 -38.8 40.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.149 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -60.77 -35.78 77.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.907 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.03 -41.88 94.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.857 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 23.9 t -56.74 -38.4 58.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.072 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -78.21 -28.94 48.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.76 -51.67 68.0 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.15 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.19 -39.23 68.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.935 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 55.9 mt -57.02 -29.58 31.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.146 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -56.39 -46.13 80.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.925 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -69.72 -11.69 61.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.81 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -89.61 -66.26 0.94 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.898 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -81.81 -45.49 15.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.898 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.69 37.34 1.74 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.533 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -129.37 142.22 44.49 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.631 0.729 . . . . 0.0 111.184 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 144.36 53.65 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.61 2.206 . . . . 0.0 112.35 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 -14.64 36.33 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.724 2.283 . . . . 0.0 112.312 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -81.57 -0.71 43.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.857 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -121.49 -37.59 2.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.961 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -85.43 155.02 21.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.913 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 45.5 mtt180 -139.06 -178.67 5.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.902 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 13.2 mt -130.0 153.98 47.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 22.0 mm -136.14 119.31 22.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.066 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -153.48 146.38 24.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.874 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 65.45 28.81 11.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.132 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 69.62 8.88 60.91 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.505 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.36 159.98 37.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.665 0.269 . . . . 0.0 110.926 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.87 128.44 34.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.87 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 5.1 mt -96.93 130.06 44.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.926 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -131.12 178.56 6.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.88 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.74 -16.86 59.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.918 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -55.28 -22.73 31.09 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.464 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 6.0 mtp85 -137.22 167.9 20.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.906 0.384 . . . . 0.0 110.821 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 64.1 p -99.19 -179.6 4.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.157 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -65.06 -44.61 88.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.907 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 11.0 p -67.46 -18.31 65.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.894 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -76.84 -30.92 56.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.915 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -100.74 15.97 26.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.937 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 13.2 t30 57.88 34.21 24.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.905 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 28.1 mm -68.93 109.08 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.183 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 81.1 mm-40 -101.24 173.47 6.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.955 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -61.02 140.38 57.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.868 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 58.63 48.93 11.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.879 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 3.3 m -82.96 137.92 34.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.872 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.67 96.63 8.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.148 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 6.0 mt -107.63 172.12 7.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.878 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 35.5 m-70 -132.39 170.06 15.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.846 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.57 119.11 30.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.952 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 23.6 t -125.36 114.81 41.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.119 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.76 119.36 38.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.94 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -111.13 77.96 1.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.861 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 9.0 mt -51.58 140.37 18.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.848 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 5.4 ppt_? -98.9 -26.28 14.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.901 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -93.39 24.01 27.39 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.463 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.351 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.422 -179.959 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.892 0.377 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 15.9 p80 -120.44 44.76 2.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.851 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 36.1 mtt -78.73 77.0 5.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.859 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.36 94.16 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.532 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -97.79 75.06 2.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.758 0.313 . . . . 0.0 111.091 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -172.58 158.81 4.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.138 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -51.84 -34.48 40.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.082 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -134.29 129.83 36.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.893 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.45 4.45 52.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.9 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.5 m -154.53 126.63 7.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.934 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.2 t -52.14 108.23 1.03 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.693 0.759 . . . . 0.0 110.903 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.86 -0.73 7.42 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.623 2.215 . . . . 0.0 112.298 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -96.26 -54.04 3.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.868 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.9 p -114.39 22.23 13.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.916 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.5 tp60 41.46 68.18 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.866 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.1 tppt? -125.08 103.88 8.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.911 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -56.31 107.99 0.43 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.881 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -63.22 153.08 35.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.823 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.48 150.45 34.25 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.59 0.71 . . . . 0.0 111.067 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 168.6 21.22 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.642 2.228 . . . . 0.0 112.352 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 39.73 40.47 0.67 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.86 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.16 -176.49 6.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.9 p -129.46 164.4 23.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.107 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -52.35 -31.44 33.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.865 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.8 tp -71.92 -33.83 68.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.858 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.88 -59.51 4.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.871 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.7 t -57.59 -37.09 56.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.229 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -71.76 -36.29 70.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.878 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.6 m -54.92 -54.02 48.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.872 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -72.54 -43.12 63.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.87 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 13.5 mt -51.91 -31.81 30.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.883 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.34 -38.81 65.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.11 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -74.27 -45.58 46.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -53.1 -52.19 59.43 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.512 1.132 . . . . 0.0 108.271 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.0 mt -52.52 -56.21 16.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.911 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.94 -22.19 47.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.074 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -102.98 8.9 38.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.871 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.6 m -116.7 167.07 11.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.879 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.8 m -124.35 -33.54 3.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.142 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -51.16 -56.1 14.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.843 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 t0 63.72 54.49 1.82 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.899 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 29.4 m -81.64 165.11 2.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.128 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 6.1 m -115.01 117.07 29.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.095 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 33.5 p90 . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.972 179.93 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.864 0.364 . . . . 0.0 110.863 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -167.99 122.25 0.95 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.91 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.6 ptt? -100.69 170.73 8.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -119.84 141.72 49.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.934 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 42.1 pt -134.43 164.86 33.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.094 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -122.43 149.11 44.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.876 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 61.6 t -136.84 117.6 17.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.137 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.22 155.49 17.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.83 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 61.8 p -112.86 170.06 8.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.143 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 63.7 mt -64.83 -15.8 62.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.937 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 24.0 p -90.43 -12.55 37.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.091 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 104.22 -8.98 49.57 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.508 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 8.6 ttmm -51.75 142.39 14.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.912 0.387 . . . . 0.0 110.881 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 27.8 m -112.34 106.42 14.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.157 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 71.8 mt -100.68 141.79 16.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.207 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 31.6 m -129.25 122.62 30.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.187 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 12.8 mt -144.49 170.57 15.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.883 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -109.77 151.31 27.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.917 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 4.1 m -146.7 174.71 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.098 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -122.15 161.32 43.45 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.621 0.724 . . . . 0.0 110.873 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 -9.21 25.52 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.712 2.275 . . . . 0.0 112.315 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 13.0 m -103.5 -19.35 14.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.861 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -59.34 -174.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.876 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 59.2 p -142.13 172.87 12.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.105 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 28.1 mm -58.35 -35.52 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.167 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -74.7 -25.02 58.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.876 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -74.45 -50.37 18.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.868 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 2.4 p -56.59 -33.39 39.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.096 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -77.69 -28.46 51.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.945 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.49 -52.57 64.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.098 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.98 -30.69 67.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 47.5 mt -63.63 -29.37 47.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.082 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -58.15 -42.69 86.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.88 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -69.73 -11.44 60.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.872 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -90.92 -65.7 0.99 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.872 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -82.12 -45.48 15.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.911 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.3 42.35 1.18 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.472 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -136.78 143.1 41.3 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.688 0.756 . . . . 0.0 111.101 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 144.79 55.33 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.707 2.272 . . . . 0.0 112.342 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 -12.74 33.47 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.693 2.262 . . . . 0.0 112.365 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -83.53 -0.3 49.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.869 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -119.6 -39.42 2.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.966 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -80.29 147.74 31.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.927 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -121.74 -178.46 3.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.89 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 12.1 mt -136.39 147.98 47.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.918 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 17.2 mm -134.0 125.71 49.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.126 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -155.81 143.3 19.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.887 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 59.1 26.37 15.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.128 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 71.89 9.54 70.9 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.45 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.87 151.37 40.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.785 0.326 . . . . 0.0 110.877 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -82.92 109.96 17.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.959 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 4.5 mt -75.86 132.69 40.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.944 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -128.25 159.44 35.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.906 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -53.29 -26.7 19.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.886 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -52.05 -25.92 18.49 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.502 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -118.37 167.64 11.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.896 0.379 . . . . 0.0 110.925 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 65.0 p -110.57 -179.4 3.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.13 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -64.28 -41.1 97.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.942 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 38.2 t -67.25 -19.73 65.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.859 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -75.42 -35.88 60.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -100.47 8.44 43.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.958 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 10.2 t30 51.23 45.02 28.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.916 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 87.9 mt -78.98 105.31 8.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.098 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 64.7 mm-40 -89.62 -169.59 2.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.957 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 29.4 tttt -70.26 155.9 40.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.92 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 51.98 52.23 14.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.894 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.4 p -91.29 132.63 36.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.92 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 5.5 m -87.04 84.49 7.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.118 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 6.1 mt -97.92 134.71 40.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 56.5 m-70 -99.14 143.26 29.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.862 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.2 tt -103.61 140.85 37.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.89 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 11.4 t -138.57 111.17 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.08 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.95 119.6 27.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.919 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 12.6 tpp85 -111.64 77.37 1.04 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.831 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 8.0 mp -51.76 167.83 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.861 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.77 118.05 34.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.886 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 110.77 -52.66 0.62 Allowed Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.472 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.489 -179.882 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 66.1 m . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.941 0.401 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -87.7 -31.73 19.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.838 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 5.7 ptm -134.99 153.06 52.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.869 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 129.17 -121.99 3.72 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.466 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 58.98 43.32 17.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.83 0.348 . . . . 0.0 111.066 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -172.57 154.88 3.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.073 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.57 -31.95 70.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.121 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -138.17 145.81 41.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.93 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.56 -1.54 21.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.842 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -154.29 123.25 6.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.886 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.9 t -51.24 106.58 0.67 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.594 0.711 . . . . 0.0 110.873 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.7 -3.8 12.71 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.703 2.269 . . . . 0.0 112.375 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.0 mtt -89.03 -54.82 3.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.86 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.0 p -113.91 19.49 16.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.955 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 44.44 67.19 0.72 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.853 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 tppt? -124.02 111.71 16.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.816 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -64.76 120.75 13.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.896 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -75.77 153.28 37.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.868 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.39 152.19 45.12 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.564 0.697 . . . . 0.0 111.074 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 170.3 16.82 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.678 2.252 . . . . 0.0 112.335 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.6 39.04 0.46 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.901 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.47 -179.12 7.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.864 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -125.76 163.95 21.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.078 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -51.29 -37.15 45.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.909 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.59 -40.06 70.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.922 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -53.6 -46.4 70.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.885 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.8 t -71.28 -55.84 12.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.113 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -51.43 -32.67 27.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.817 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.3 m -54.53 -54.63 38.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.84 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -70.15 -35.25 73.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.925 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.89 -44.47 70.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.907 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.51 -33.72 76.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.048 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -73.82 -53.1 11.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.935 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -53.49 -56.96 12.6 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.5 1.125 . . . . 0.0 108.327 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 24.8 tp -52.34 -48.79 65.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.998 -1.001 . . . . 0.0 110.909 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.09 -22.04 65.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.115 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -99.39 -2.52 36.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.896 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -112.05 157.13 21.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.856 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.0 p -107.83 4.22 25.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.159 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -110.44 103.94 12.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.91 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -80.0 62.88 4.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.801 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.5 p -77.93 145.28 10.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.106 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 33.0 m -99.74 111.0 23.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.143 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 38.3 p90 . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.895 -179.997 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 5.3 m . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.907 0.384 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -134.66 -81.09 0.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.906 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -172.13 155.83 3.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.847 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -109.18 147.41 32.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.989 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 44.4 pt -139.76 155.24 24.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.099 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -120.24 141.4 49.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.891 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 39.0 t -129.0 125.64 63.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.067 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.23 154.23 18.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.917 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 39.5 p -111.54 175.24 5.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.093 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 12.8 mt -71.55 -12.94 61.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.878 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 49.1 p -90.43 -12.62 36.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.156 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 102.7 -15.12 56.03 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.501 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 19.0 ttmt -51.74 155.22 1.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.885 0.374 . . . . 0.0 110.848 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 54.9 m -118.83 107.48 13.67 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.095 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 63.7 mt -97.11 141.89 14.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.142 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 11.6 m -129.2 131.2 47.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.161 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 17.8 mt -150.13 170.43 18.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.915 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -109.78 148.58 31.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.897 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 23.8 m -148.65 169.22 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.128 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -113.09 157.65 40.21 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.711 0.767 . . . . 0.0 110.825 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -10.39 28.38 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.667 2.245 . . . . 0.0 112.372 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 14.8 m -107.33 -13.05 15.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.834 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -63.86 -175.21 0.13 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.875 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 21.6 p -132.1 165.99 22.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.121 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 37.9 mm -57.51 -41.06 78.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.113 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -57.56 -33.23 67.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.872 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.52 -42.44 74.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.864 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 36.1 t -56.67 -35.52 45.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.147 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 34.3 mttm -78.56 -28.7 45.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.909 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.56 -51.88 66.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.064 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.57 -39.88 70.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.942 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 51.6 mt -53.68 -29.92 18.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.114 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -60.78 -41.49 95.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.925 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -68.81 -11.49 60.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.819 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.86 -66.12 0.94 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.905 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -80.5 -46.44 15.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.863 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.27 35.03 2.19 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.495 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -124.97 142.07 40.11 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.579 0.704 . . . . 0.0 111.107 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.86 144.59 53.98 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.619 2.213 . . . . 0.0 112.338 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 -13.06 34.11 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.705 2.27 . . . . 0.0 112.36 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -82.62 -1.45 51.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.896 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -122.25 -38.14 2.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.9 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -83.38 153.66 24.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.908 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 29.0 mtt-85 -137.03 179.56 6.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.852 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 13.0 mt -128.04 152.4 47.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.855 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 23.7 mm -138.61 111.14 6.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.095 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -146.35 145.43 30.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.854 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 63.93 24.37 13.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.083 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 68.68 28.35 73.2 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.467 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -143.99 154.3 43.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.791 0.329 . . . . 0.0 110.905 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -84.46 109.7 18.1 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.857 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 3.8 mt -81.31 131.39 35.29 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.919 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -137.99 -179.66 5.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.95 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.02 -16.57 60.28 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.829 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -58.87 -19.01 42.14 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.512 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 14.1 mtp85 -140.31 167.79 21.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.859 0.361 . . . . 0.0 110.882 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 41.4 p -101.2 -179.86 4.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.211 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -64.06 -47.61 79.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.944 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 8.5 p -65.48 -16.29 63.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.842 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.44 -32.54 58.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.824 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -100.7 16.05 26.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.895 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 8.2 t30 59.08 34.97 23.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.898 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 28.9 mm -68.61 104.22 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.151 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 65.8 mm-40 -96.42 175.63 6.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.895 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 38.1 tttt -60.5 141.82 56.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.883 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 63.99 35.95 10.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.858 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.5 m -67.68 128.95 38.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.814 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.26 96.31 9.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.145 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 4.9 mp -106.76 166.76 10.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.949 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -115.59 169.9 8.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.933 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.28 129.66 51.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.919 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 90.7 t -133.03 123.0 47.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.12 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.66 118.46 36.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.922 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -111.23 77.73 1.06 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.851 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 14.4 mt -51.38 128.43 22.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.884 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -68.39 -49.93 56.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.887 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 130.05 68.42 0.11 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.511 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.376 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.505 -179.88 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 21.9 m . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.89 0.376 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 11.6 t60 -156.84 130.43 8.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.826 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -133.28 172.97 11.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.827 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 129.01 -16.3 5.79 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.505 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -94.84 37.67 1.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.824 0.345 . . . . 0.0 111.09 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.93 142.69 0.53 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.071 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -87.95 -21.24 25.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.134 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -132.05 130.26 41.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.918 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -92.76 -2.46 55.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.841 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -154.41 127.28 8.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 32.4 t -51.85 107.59 0.87 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.609 0.719 . . . . 0.0 110.958 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -2.65 10.5 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.704 2.269 . . . . 0.0 112.327 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.67 -54.68 3.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.844 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.4 p -114.03 21.09 15.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.896 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 43.17 66.08 0.85 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.869 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.3 tppt? -122.51 106.69 11.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.894 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -59.29 120.72 9.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.933 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -76.83 153.24 35.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.892 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.69 154.06 68.02 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.579 0.704 . . . . 0.0 111.065 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.85 167.8 23.51 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.691 2.261 . . . . 0.0 112.287 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 39.96 40.11 0.69 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.84 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.0 -177.31 6.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.993 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.8 p -128.92 163.62 24.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.155 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.1 -36.77 51.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.927 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.3 tp -71.65 -32.18 67.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.925 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -62.68 -48.67 78.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.81 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.4 t -75.06 -38.72 43.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.13 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -65.07 -41.5 95.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.843 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.2 m -51.7 -53.91 34.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.841 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -70.45 -42.05 72.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.834 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -53.24 -33.54 53.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.898 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.69 -39.07 67.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.105 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -72.28 -48.89 39.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.08 -52.16 61.84 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.553 1.158 . . . . 0.0 108.33 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 23.6 tp -55.73 -45.85 77.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.9 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.06 -24.51 62.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.15 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -89.64 -34.69 16.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.898 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.2 t -96.99 113.01 24.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.936 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.0 t -63.52 -27.26 69.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.149 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -61.83 134.29 56.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.852 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -113.29 58.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.899 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 17.0 m -82.39 119.66 32.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.09 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.83 131.03 35.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.138 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 29.5 p90 . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.871 179.966 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.943 0.401 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -124.1 -174.61 3.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.871 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 7.9 ptt? -100.01 173.79 6.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.918 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -118.15 157.18 27.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.915 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 14.7 pt -145.06 166.47 11.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.075 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -124.45 152.97 42.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.885 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 62.1 t -134.74 132.27 54.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.116 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -108.69 136.46 48.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.945 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 2.3 p -99.3 164.1 12.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.167 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.9 mp -66.79 -13.88 62.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.893 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 5.1 t -90.2 -3.6 57.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.118 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 97.29 -27.55 18.03 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.471 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -52.49 140.22 23.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.814 0.34 . . . . 0.0 110.883 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 83.8 m -110.07 141.71 42.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.044 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 64.4 mt -125.36 141.99 43.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.164 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 13.9 m -125.69 110.33 13.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.15 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 11.6 mt -129.12 168.93 15.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -103.86 146.29 28.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.872 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 34.5 m -146.74 157.83 10.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.216 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 118' ' ' GLU . . . . . 0.408 ' HB3' ' HD2' ' B' ' 119' ' ' PRO . 8.0 mt-10 -100.83 155.6 36.14 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.622 0.725 . . . . 0.0 110.851 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 119' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' B' ' 118' ' ' GLU . 52.8 Cg_endo -69.78 -8.31 23.27 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.71 2.273 . . . . 0.0 112.326 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 3.6 m -109.56 -10.43 14.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.824 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -64.46 -174.03 0.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.854 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 22.9 p -130.55 176.52 8.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.101 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 39.5 mm -65.3 -50.89 70.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.159 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -57.51 -20.3 30.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.857 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.84 -51.24 23.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.944 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . 0.41 HG22 ' N ' ' B' ' 127' ' ' LYS . 3.5 m -56.44 -24.76 19.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.101 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 127' ' ' LYS . . . . . 0.41 ' N ' HG22 ' B' ' 126' ' ' VAL . 40.9 mttm -79.86 -31.79 40.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.892 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.59 -51.32 69.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.171 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -39.97 68.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.82 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 37.3 mt -58.06 -30.25 38.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.082 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -57.31 -45.13 84.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.901 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -71.97 -11.37 60.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.915 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.46 -66.13 0.93 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.895 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -85.07 -42.23 15.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.879 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.48 42.2 1.17 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.524 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -132.07 142.28 44.52 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.611 0.72 . . . . 0.0 111.089 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 143.84 52.06 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.68 2.253 . . . . 0.0 112.362 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 -12.68 33.41 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.624 2.216 . . . . 0.0 112.352 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -83.19 -1.07 52.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.91 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -121.86 -37.86 2.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.969 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -84.04 145.61 28.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.959 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 26.5 mmt85 -129.6 178.42 6.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.82 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 6.6 tp -121.51 151.68 40.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.935 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 30.8 mm -139.65 110.36 4.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.109 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -138.22 141.95 39.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.884 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 63.67 24.53 13.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.098 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 71.48 13.34 74.13 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.439 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -123.54 166.27 15.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.729 0.299 . . . . 0.0 110.933 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -92.25 123.7 35.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.921 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 2.2 mt -96.91 130.99 44.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.898 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -128.09 170.14 13.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.843 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -60.78 -19.22 58.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.843 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -56.47 -22.24 37.63 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.497 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 15.9 mtt-85 -128.36 166.65 18.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.896 0.379 . . . . 0.0 110.883 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 69.8 p -101.2 -179.71 4.12 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.122 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -64.97 -47.88 76.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.017 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 34.1 t -66.03 -15.72 63.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.815 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.79 -32.67 62.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.834 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -100.7 16.11 26.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.884 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 9.4 t30 59.17 34.64 23.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.882 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 77.9 mt -80.94 95.57 2.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.147 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -90.16 -169.5 2.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.982 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -62.55 150.09 41.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.88 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 51.18 55.83 8.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.895 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 2.3 m -89.86 132.47 35.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.873 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.49 94.35 9.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.087 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 2.8 mp -112.82 142.2 45.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.949 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -97.62 169.96 9.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.841 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 4.7 tp -120.9 143.04 49.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.878 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 26.0 t -132.93 112.71 18.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.146 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.77 114.79 29.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -111.33 77.89 1.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.878 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.29 113.99 3.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.904 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.2 141.21 57.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.792 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -57.82 102.69 0.25 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.445 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.375 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.452 -179.973 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.0 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.917 0.389 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -83.13 -38.49 22.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.927 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 18.2 mmt -109.34 177.92 4.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.828 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 167.31 89.67 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.479 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -97.76 72.47 2.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.779 0.323 . . . . 0.0 111.135 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -170.51 154.94 4.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.053 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.4 -34.41 61.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.117 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.09 133.38 42.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.919 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.66 2.04 49.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.917 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -154.26 125.55 7.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.818 -179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.6 t -51.98 108.02 0.97 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.679 0.752 . . . . 0.0 110.94 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -2.63 10.53 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.632 2.221 . . . . 0.0 112.346 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 15.6 mtm -93.08 -54.49 3.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.892 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.9 p -112.63 21.09 15.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.9 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 42.08 63.38 1.37 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.893 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -122.02 105.72 10.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.888 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -57.08 112.66 1.42 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.869 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -66.27 153.56 42.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.861 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.91 152.74 47.75 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.564 0.697 . . . . 0.0 111.136 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 168.1 22.54 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.684 2.256 . . . . 0.0 112.325 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.57 40.69 0.65 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.817 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.41 -176.89 6.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.998 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.1 p -129.31 162.24 28.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.166 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 21.8 mm100 -51.09 -36.23 39.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.882 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.0 tp -71.85 -34.27 69.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.916 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -60.09 -50.56 73.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.856 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.7 t -71.09 -30.27 40.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.134 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -71.21 -43.2 67.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.823 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.4 m -51.67 -53.98 33.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.893 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -68.26 -44.89 74.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.833 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.5 mt -52.47 -36.57 55.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.905 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.32 -41.68 96.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.125 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -74.06 -50.0 21.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.903 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.28 -42.23 69.79 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.473 1.108 . . . . 0.0 108.24 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 23.1 tp -64.66 -49.71 69.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.954 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.82 -23.1 64.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.066 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -93.71 -21.45 19.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.885 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.1 t -70.47 153.69 42.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.872 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -105.82 -17.68 14.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.192 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -114.18 132.75 55.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.887 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -88.97 70.34 8.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.884 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.7 m -81.84 127.09 39.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.159 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.1 m -90.32 118.25 29.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.18 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 33.4 p90 . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.887 -179.977 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 49.7 p . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.865 0.364 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -164.95 126.31 2.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.856 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 10.3 ptt? -106.51 172.45 6.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.938 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -127.76 159.68 34.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.924 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 41.5 pt -142.92 162.68 17.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.107 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -126.91 119.23 26.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.85 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' VAL . . . . . . . . . . . . . 21.9 t -108.31 118.52 56.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.137 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.08 126.54 43.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.898 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 79.0 p -64.42 173.68 1.99 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.145 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.6 tp -79.95 -1.16 38.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.935 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.7 t -105.93 -12.9 15.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.142 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 120.55 -25.45 7.28 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.453 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -48.68 138.63 10.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.809 0.338 . . . . 0.0 110.916 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 90.6 m -108.77 119.63 40.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.215 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 62.3 mt -109.11 142.41 21.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.111 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 19.8 m -128.0 125.74 39.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.135 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 13.2 mt -146.99 159.48 43.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -96.79 140.68 31.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.875 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 34.0 m -144.43 156.58 14.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.126 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -103.95 161.61 22.43 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.623 0.725 . . . . 0.0 110.903 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 -24.43 29.64 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.716 2.278 . . . . 0.0 112.353 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 56.9 p -90.28 -12.35 38.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.828 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -61.57 -174.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.899 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 33.8 p -137.25 162.16 34.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.21 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 41.8 mm -55.07 -34.72 32.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.159 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -72.39 -20.49 61.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -75.93 -52.78 9.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.925 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 3.8 m -56.8 -28.23 27.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.165 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 9.6 mmtt -78.6 -29.62 46.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.923 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.47 -51.78 68.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.046 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.77 -39.63 73.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.927 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 40.9 mt -54.88 -31.3 24.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.163 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -57.44 -43.19 83.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.899 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -72.67 -12.39 61.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.868 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -88.14 -64.39 1.15 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.941 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.91 -44.83 16.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.899 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.32 39.65 1.48 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.459 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -135.29 147.75 63.45 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.613 0.72 . . . . 0.0 111.152 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 143.03 49.75 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.667 2.245 . . . . 0.0 112.367 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.68 -9.98 27.49 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.725 2.284 . . . . 0.0 112.369 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -83.6 -0.19 49.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.863 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -120.85 -39.29 2.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.869 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -83.67 147.94 27.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.9 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 82.8 mtt180 -138.82 172.12 13.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 5.9 mt -114.06 153.58 29.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.887 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 23.5 mm -137.45 103.25 2.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.179 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -138.47 147.52 43.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.883 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 67.56 24.03 8.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.091 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 70.64 8.39 63.24 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.458 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.69 163.75 16.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.762 0.315 . . . . 0.0 110.916 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -89.1 109.83 20.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.896 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 3.6 mt -77.63 129.65 35.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.864 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -138.04 172.74 12.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.906 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -60.02 -19.21 51.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.87 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -57.27 -21.38 39.85 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.458 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 11.5 mtp180 -131.43 167.75 18.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.926 0.393 . . . . 0.0 110.865 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 39.8 p -101.66 179.92 4.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.174 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.87 -48.09 72.71 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.9 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 43.0 t -64.83 -20.59 66.48 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.856 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.2 -31.25 68.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.808 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -100.78 13.54 34.6 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.882 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 14.5 t30 50.81 44.58 27.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.878 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 161' ' ' ILE . . . . . . . . . . . . . 92.3 mt -83.03 111.15 18.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.167 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 -93.79 -176.2 3.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.858 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 36.0 tttt -69.43 145.37 52.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.912 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 62.91 36.94 12.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.94 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 2.3 m -72.83 139.36 46.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.875 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.09 107.22 19.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.153 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 1.1 mp -126.5 172.85 9.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.91 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -121.59 169.6 10.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.863 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.05 127.89 55.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.897 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 170' ' ' VAL . . . . . . . . . . . . . 16.1 t -125.53 114.21 38.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.09 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -101.46 119.47 38.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.91 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 -111.06 96.46 6.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.892 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -84.72 145.72 27.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.906 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -75.76 102.77 5.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.853 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 151.88 -47.76 0.56 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.548 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.506 -179.987 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.483 ' C ' HD23 ' A' ' 8' ' ' LEU . . . . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.81 0.338 . . . . 0.0 111.077 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 1.117 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -151.97 143.39 23.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.876 -179.95 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.1 ttp85 -102.1 -16.04 16.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.889 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -137.47 124.4 21.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.838 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.4 t -51.24 106.64 0.68 Allowed Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 121.581 0.705 . . . . 0.0 110.925 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.76 -3.92 12.98 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.611 2.207 . . . . 0.0 112.307 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -90.03 -55.1 3.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.829 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.3 p -112.13 19.53 17.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.871 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 42.93 63.06 1.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.945 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.3 ttpt -125.89 113.78 17.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.884 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -61.83 120.41 10.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.896 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.624 ' HE2' HD12 ' A' ' 8' ' ' LEU . 57.5 m-85 -71.39 153.66 42.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.841 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.91 151.01 66.53 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.555 0.693 . . . . 0.0 111.128 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 170.57 16.31 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.671 2.247 . . . . 0.0 112.4 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 40.67 37.84 0.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.901 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.435 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.6 OUTLIER -83.61 -175.98 6.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.964 -179.983 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.6 p -132.29 162.32 31.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.167 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.44 -30.65 20.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.891 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.6 HD13 HG21 ' B' ' 166' ' ' THR . 9.2 tp -72.11 -37.14 69.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.972 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.28 -59.89 4.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.837 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.684 HG11 ' HG ' ' A' ' 8' ' ' LEU . 22.7 t -54.6 -48.64 70.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.139 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 49.9 m-20 -60.25 -43.43 96.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.854 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.4 m -51.97 -47.56 64.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.848 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -75.43 -40.8 57.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 1.117 HD11 HD11 ' A' ' 8' ' ' LEU . 26.7 mt -57.78 -28.58 64.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.909 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.403 ' HA ' HG21 ' B' ' 170' ' ' VAL . . . -73.44 -51.09 18.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.092 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.736 ' HA ' HD21 ' B' ' 108' ' ' LEU . 3.1 pt20 -68.45 -32.28 72.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.921 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 t -71.82 -49.25 40.21 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.476 1.11 . . . . 0.0 108.318 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.76 HD22 HD11 ' B' ' 144' ' ' ILE . 5.9 tp -52.35 -47.13 66.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.934 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.964 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -58.88 -38.52 79.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.049 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -73.84 -34.35 64.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.91 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.8 p -63.98 162.72 13.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.895 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 68.5 p -107.51 -24.72 11.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.194 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -104.16 125.7 50.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.861 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -94.21 59.54 2.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.881 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 32.8 m -74.33 149.97 7.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.119 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 51.4 m -98.05 112.21 24.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.143 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 36.8 p90 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.899 179.996 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 96.0 p . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.929 0.395 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -122.88 125.66 45.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.864 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 101' ' ' MET . . . . . 0.633 ' HE2' HG23 ' B' ' 117' ' ' VAL . 7.0 ptt? -101.49 155.47 18.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.908 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -103.66 154.86 19.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.903 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 103' ' ' ILE . . . . . 0.604 HD11 HG13 ' B' ' 126' ' ' VAL . 42.0 pt -147.35 155.22 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.166 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -122.53 143.43 49.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.86 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 105' ' ' VAL . . . . . 0.427 HG22 ' HB2' ' B' ' 167' ' ' LEU . 42.5 t -138.06 113.82 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.112 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -99.29 147.38 25.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.92 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 107' ' ' THR . . . . . 0.45 HG22 ' CB ' ' B' ' 169' ' ' LEU . 60.8 p -100.07 179.11 4.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.132 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 108' ' ' LEU . . . . . 0.736 HD21 ' HA ' ' A' ' 33' ' ' GLN . 6.7 mp -73.2 -9.79 59.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.874 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 50.9 p -90.89 -12.59 35.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.106 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 106.56 -22.17 31.07 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.472 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 111' ' ' LYS . . . . . 0.419 ' NZ ' HD11 ' B' ' 113' ' ' ILE . 26.0 ttpp -51.8 141.87 16.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.856 0.36 . . . . 0.0 110.915 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 6.5 m -118.95 117.5 28.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.136 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 113' ' ' ILE . . . . . 0.423 HD13 HG23 ' B' ' 130' ' ' ILE . 51.2 mt -102.03 134.39 42.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.17 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 95.2 m -119.16 109.89 16.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.117 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.67 HD21 ' CE ' ' B' ' 133' ' ' LYS . 19.9 mt -133.66 170.11 16.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.895 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -110.88 148.45 32.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.794 HG11 HG22 ' B' ' 126' ' ' VAL . 19.6 m -145.57 161.52 12.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.132 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -104.56 160.9 24.48 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-O 121.709 0.766 . . . . 0.0 110.835 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 -23.21 30.89 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.635 2.223 . . . . 0.0 112.365 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 15.0 p -93.62 -10.05 35.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.843 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 -66.69 -175.82 0.43 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.884 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 122' ' ' THR . . . . . 0.789 HG22 HG22 ' B' ' 155' ' ' THR . 37.9 p -133.21 165.37 24.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.126 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 123' ' ' ILE . . . . . 0.835 HG23 HD12 ' B' ' 143' ' ' LEU . 31.6 mm -55.12 -48.45 76.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.17 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.97 -34.39 63.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.912 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -43.75 94.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.875 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 126' ' ' VAL . . . . . 0.794 HG22 HG11 ' B' ' 117' ' ' VAL . 41.0 t -56.95 -32.61 39.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.146 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 127' ' ' LYS . . . . . 0.795 ' HE3' HG22 ' B' ' 123' ' ' ILE . 26.2 mttt -78.95 -28.87 43.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.89 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.59 -51.6 68.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.082 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.626 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -72.06 -37.31 69.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.933 179.951 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 130' ' ' ILE . . . . . 0.532 ' CG1' HD12 ' B' ' 115' ' ' LEU . 66.4 mt -61.22 -28.87 44.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.124 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -58.59 -43.49 89.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.921 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -70.98 -11.5 61.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.81 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 133' ' ' LYS . . . . . 0.67 ' CE ' HD21 ' B' ' 115' ' ' LEU . 4.4 mptp? -88.99 -66.41 0.92 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.933 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -81.85 -44.32 17.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.883 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.29 35.53 2.1 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.447 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 136' ' ' ILE . . . . . 0.71 HD13 HD11 ' B' ' 171' ' ' LEU . 0.9 OUTLIER -125.0 141.54 38.7 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.652 0.739 . . . . 0.0 111.1 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 143.53 50.98 Favored 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.652 2.235 . . . . 0.0 112.41 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 138' ' ' PRO . . . . . 0.411 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.7 Cg_endo -69.76 -12.81 33.67 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.714 2.276 . . . . 0.0 112.325 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -83.13 -1.59 53.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.84 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -122.09 -38.18 2.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.961 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 141' ' ' GLN . . . . . 0.563 ' HB2' HD11 ' B' ' 169' ' ' LEU . 15.3 pt20 -83.78 148.23 27.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.96 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 20.5 mmm-85 -132.44 176.82 8.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.874 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 143' ' ' LEU . . . . . 0.835 HD12 HG23 ' B' ' 123' ' ' ILE . 17.5 mt -125.36 147.79 49.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.896 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.76 HD11 HD22 ' A' ' 35' ' ' LEU . 23.2 mm -134.94 122.2 36.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.097 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 145' ' ' PHE . . . . . 0.765 ' HB3' HD11 ' B' ' 150' ' ' LEU . 53.0 t80 -157.76 144.48 17.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.894 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 62.86 27.97 16.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.072 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 147' ' ' GLY . . . . . 0.502 ' HA3' HD21 ' A' ' 8' ' ' LEU . . . 62.88 28.75 72.38 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.514 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -136.53 151.98 50.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.797 0.332 . . . . 0.0 110.914 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -81.8 109.54 16.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.87 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.765 HD11 ' HB3' ' B' ' 145' ' ' PHE . 3.8 mt -83.0 124.41 30.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.931 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -141.38 178.14 7.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.74 -19.06 58.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.928 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -58.08 -20.15 41.19 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.471 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 10.7 mtt180 -137.72 167.74 21.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.923 0.392 . . . . 0.0 110.851 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 155' ' ' THR . . . . . 0.789 HG22 HG22 ' B' ' 122' ' ' THR . 64.3 p -103.97 179.95 4.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.182 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 156' ' ' LEU . . . . . 0.542 HD13 HD12 ' B' ' 161' ' ' ILE . 4.3 mm? -63.01 -47.78 81.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.915 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 40.5 t -62.17 -18.85 62.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.869 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -70.63 -36.57 73.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.926 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 159' ' ' TYR . . . . . 0.54 ' CG ' HD22 ' B' ' 150' ' ' LEU . 62.4 m-85 -100.61 15.73 27.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.902 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 9.3 t30 52.42 36.19 19.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.817 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 161' ' ' ILE . . . . . 0.596 HD11 HD13 ' B' ' 150' ' ' LEU . 96.8 mt -75.43 101.92 2.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.081 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -91.55 -170.91 2.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.973 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 23.3 tttm -67.83 142.72 56.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.875 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 63.28 54.06 2.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 14.4 m -92.3 135.2 34.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.848 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 166' ' ' THR . . . . . 0.6 HG21 HD13 ' A' ' 25' ' ' LEU . 0.3 OUTLIER -90.07 93.45 9.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.165 -179.945 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.44 HD23 HD12 ' B' ' 150' ' ' LEU . 5.0 mp -106.38 159.54 16.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.92 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 5.1 m80 -112.87 169.59 8.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.848 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 169' ' ' LEU . . . . . 0.563 HD11 ' HB2' ' B' ' 141' ' ' GLN . 0.3 OUTLIER -121.35 128.89 52.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.967 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 170' ' ' VAL . . . . . 0.964 HG13 ' HB2' ' A' ' 36' ' ' ALA . 45.9 t -133.05 121.06 42.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.09 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.71 HD11 HD13 ' B' ' 136' ' ' ILE . 0.3 OUTLIER -105.71 119.29 38.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.962 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 19.8 mmm-85 -111.16 77.86 1.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.855 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 6.7 mt . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.944 -179.976 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.512 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.817 0.341 . . . . 0.0 111.086 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.822 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -143.28 139.05 29.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.935 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.78 8.54 28.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.855 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -155.32 124.2 6.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.898 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.423 ' HA ' ' HD2' ' A' ' 12' ' ' PRO . 22.2 t -51.8 107.75 0.9 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.573 0.701 . . . . 0.0 110.853 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 11' ' ' CYS . 53.4 Cg_endo -69.77 -1.1 7.9 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.652 2.235 . . . . 0.0 112.356 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -94.63 -54.3 3.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.869 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.6 p -114.78 21.58 14.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.903 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 42.55 69.09 0.41 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.97 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -125.85 105.42 8.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.937 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -57.17 112.02 1.24 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.859 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.684 ' CE2' HG13 ' A' ' 27' ' ' VAL . 31.0 m-85 -67.47 153.29 44.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.949 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.08 151.52 34.33 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.546 0.689 . . . . 0.0 111.119 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.64 168.7 20.63 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.739 2.293 . . . . 0.0 112.386 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.4 ptt-85 39.7 40.34 0.65 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.863 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.471 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -83.79 -176.27 6.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.923 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.9 p -128.63 163.59 24.72 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.1 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -53.01 -31.77 42.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.87 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 13.4 tp -71.9 -32.01 66.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.942 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.24 -60.4 3.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.854 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.684 HG13 ' CE2' ' A' ' 18' ' ' PHE . 67.2 t -54.76 -37.81 41.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.119 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.464 ' OD1' HG22 ' B' ' 144' ' ' ILE . 85.6 m-20 -72.14 -38.99 69.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.862 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.6 m -51.39 -53.98 31.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.85 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 23.0 t-80 -71.55 -43.66 65.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.898 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.822 HD11 HD11 ' A' ' 8' ' ' LEU . 13.3 mt -52.39 -29.63 25.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.918 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.05 -41.77 63.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.139 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -74.14 -40.48 62.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.978 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.1 t -57.83 -41.44 82.29 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.471 1.107 . . . . 0.0 108.323 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.614 HD12 HD11 ' B' ' 144' ' ' ILE . 14.3 mt -64.91 -58.82 5.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.89 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.745 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -58.03 -22.14 48.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.091 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -90.07 -24.18 21.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.862 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 t -102.07 165.0 11.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.848 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.7 t -124.92 1.25 8.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.073 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -71.1 -42.44 69.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.879 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.6 t0 61.08 53.97 3.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.914 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 16.7 t -77.4 151.87 5.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.147 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 55.4 m -123.49 118.5 27.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.112 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 40.8 p90 . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.973 179.899 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 68.7 m . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.925 0.393 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -126.16 122.91 37.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.87 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.5 ptt? -106.4 168.49 9.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.875 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -120.29 156.84 30.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.921 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 103' ' ' ILE . . . . . 0.595 HG22 ' HB3' ' B' ' 165' ' ' SER . 24.6 pt -146.39 155.21 12.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.132 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -119.44 117.47 28.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.94 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 105' ' ' VAL . . . . . 0.625 HG21 HD11 ' B' ' 130' ' ' ILE . 66.9 t -106.42 122.06 59.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.092 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 2.3 ttmm -99.26 146.91 25.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.953 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 37.5 p -93.12 164.52 13.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.159 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 6.4 tp -61.94 -17.64 57.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.913 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.6 p -90.35 -12.72 36.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.15 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 109.65 -13.08 32.71 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.427 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 43.1 tttm -51.64 138.4 23.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.844 0.354 . . . . 0.0 110.865 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 24.8 m -105.35 124.3 49.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.146 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 72.5 mt -119.38 139.9 45.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.156 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 5.4 m -123.0 128.96 50.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.095 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.709 HD13 ' HG3' ' B' ' 129' ' ' LYS . 15.4 mt -149.78 170.33 18.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.856 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -108.38 151.91 25.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.896 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.698 HG11 HG22 ' B' ' 126' ' ' VAL . 6.4 m -148.62 175.06 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.076 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -125.6 160.99 53.21 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.706 0.765 . . . . 0.0 110.831 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 -26.57 27.3 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.678 2.252 . . . . 0.0 112.365 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.6 p -89.41 -15.89 32.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.861 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -63.51 -176.23 0.15 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.868 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 122' ' ' THR . . . . . 0.558 HG22 HG22 ' B' ' 155' ' ' THR . 17.4 p -133.41 170.95 14.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.185 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 123' ' ' ILE . . . . . 0.772 HG23 HD12 ' B' ' 143' ' ' LEU . 36.5 mm -60.5 -37.37 74.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.15 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -63.21 -33.16 74.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.911 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.88 -44.27 81.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.853 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 126' ' ' VAL . . . . . 0.698 HG22 HG11 ' B' ' 117' ' ' VAL . 41.9 t -56.34 -36.95 48.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.143 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -78.58 -28.36 45.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.933 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.75 -51.67 67.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.097 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.709 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -71.89 -37.39 70.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.955 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 130' ' ' ILE . . . . . 0.625 HD11 HG21 ' B' ' 105' ' ' VAL . 62.0 mt -59.31 -28.85 40.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.076 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -58.38 -43.74 88.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.89 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -70.23 -11.93 61.24 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.866 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 133' ' ' LYS . . . . . 0.605 ' CE ' HD21 ' B' ' 115' ' ' LEU . 4.9 mptp? -89.84 -66.07 0.96 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.869 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -80.7 -45.59 16.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.869 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.2 38.62 1.63 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.466 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 136' ' ' ILE . . . . . 0.935 HD13 HD11 ' B' ' 171' ' ' LEU . 0.4 OUTLIER -130.91 143.62 50.15 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.633 0.73 . . . . 0.0 111.12 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 142.93 49.2 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.715 2.276 . . . . 0.0 112.324 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 138' ' ' PRO . . . . . 0.41 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.7 Cg_endo -69.79 -12.35 32.66 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.686 2.258 . . . . 0.0 112.295 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -83.65 -0.75 51.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.83 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -121.88 -40.23 2.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.944 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 141' ' ' GLN . . . . . 0.493 ' HB2' HD11 ' B' ' 169' ' ' LEU . 15.9 pt20 -79.65 141.74 36.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.878 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -120.35 175.66 5.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.888 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 143' ' ' LEU . . . . . 0.772 HD12 HG23 ' B' ' 123' ' ' ILE . 12.3 mt -129.22 147.58 51.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.921 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.63 HD13 ' O ' ' B' ' 143' ' ' LEU . 17.6 mm -133.4 109.04 13.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.18 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 145' ' ' PHE . . . . . 0.753 ' CB ' HD11 ' B' ' 150' ' ' LEU . 28.5 t80 -143.01 145.63 33.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.943 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 63.93 25.11 13.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.084 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 147' ' ' GLY . . . . . 0.582 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 69.58 11.25 65.08 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.497 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 1.8 mtmt -125.61 152.02 45.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.694 0.283 . . . . 0.0 110.917 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -80.3 109.7 15.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.869 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.753 HD11 ' CB ' ' B' ' 145' ' ' PHE . 3.8 mt -76.12 141.87 41.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.891 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -147.81 170.61 17.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.909 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -60.83 -18.86 58.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.839 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.19 -17.38 45.37 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.535 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 15.3 mtt180 -133.62 167.58 20.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.911 0.386 . . . . 0.0 110.874 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 155' ' ' THR . . . . . 0.558 HG22 HG22 ' B' ' 122' ' ' THR . 71.7 p -104.2 -179.91 4.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.119 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 156' ' ' LEU . . . . . 0.791 HD13 HD12 ' B' ' 161' ' ' ILE . 4.5 mm? -65.62 -47.64 74.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 76.1 p -63.0 -23.86 67.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.886 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -68.72 -31.94 71.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.852 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 159' ' ' TYR . . . . . 0.455 ' CG ' HD22 ' B' ' 150' ' ' LEU . 38.9 m-85 -100.62 15.3 28.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.914 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 5.1 t30 51.14 32.11 7.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.895 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 161' ' ' ILE . . . . . 0.791 HD12 HD13 ' B' ' 156' ' ' LEU . 83.0 mt -72.76 103.82 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.085 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 67.5 mm-40 -93.47 -169.73 2.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.94 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 22.1 tttt -66.21 144.99 56.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 63.43 50.02 3.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 165' ' ' SER . . . . . 0.595 ' HB3' HG22 ' B' ' 103' ' ' ILE . 1.5 t -87.27 122.49 31.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.896 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 1.4 m -90.68 113.81 25.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.124 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.71 HD23 ' HB2' ' B' ' 145' ' ' PHE . 0.4 OUTLIER -128.3 163.94 23.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.919 179.952 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -107.95 170.02 8.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.875 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 169' ' ' LEU . . . . . 0.552 ' CD1' HD12 ' B' ' 171' ' ' LEU . 0.6 OUTLIER -121.56 121.33 37.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.896 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 170' ' ' VAL . . . . . 0.745 HG13 ' HB2' ' A' ' 36' ' ' ALA . 17.6 t -124.11 109.93 24.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.07 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.935 HD11 HD13 ' B' ' 136' ' ' ILE . 0.1 OUTLIER -88.44 125.97 34.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.867 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 4.7 mtp180 -111.08 84.94 2.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.904 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 5.3 mt . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.954 179.991 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.485 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . . . . . . 0 C--O 1.233 0.197 0 CA-C-O 120.811 0.339 . . . . 0.0 111.089 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.953 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -141.94 150.11 41.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.846 -179.965 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.36 -10.12 16.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.906 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -146.19 127.56 14.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.898 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.4 t -51.16 106.67 0.68 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.577 0.704 . . . . 0.0 110.9 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 -2.22 9.74 Favored 'Trans proline' 0 N--CA 1.465 -0.196 0 C-N-CA 122.745 2.297 . . . . 0.0 112.431 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 5.9 mtm -93.42 -54.86 3.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.877 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 15.2 p -114.06 22.38 13.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.901 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 41.58 70.31 0.28 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.902 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.0 tppt? -128.08 106.7 9.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.833 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -60.7 115.13 3.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.897 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.636 ' HE2' HD12 ' A' ' 8' ' ' LEU . 54.1 m-85 -70.99 153.8 42.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.847 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.59 151.97 68.61 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.596 0.712 . . . . 0.0 111.068 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.85 171.86 13.78 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.599 2.199 . . . . 0.0 112.286 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.79 37.87 0.39 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.893 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.435 ' C ' HD12 ' A' ' 22' ' ' LEU . 0.6 OUTLIER -83.99 -175.86 6.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.972 179.98 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 80.8 p -131.27 163.89 26.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.18 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -50.85 -31.84 18.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.863 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 1.014 HD12 HG21 ' B' ' 166' ' ' THR . 10.1 tt -72.18 -38.86 69.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.883 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -57.77 -46.69 84.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.861 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.568 HG11 ' HG ' ' A' ' 8' ' ' LEU . 18.7 t -72.05 -54.62 16.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.091 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -52.99 -43.01 66.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.87 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.6 m -51.38 -49.19 62.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.829 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 31.0 t-80 -73.66 -45.95 49.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.802 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.953 HD11 HD11 ' A' ' 8' ' ' LEU . 62.4 mt -54.27 -25.67 24.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.922 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.41 -51.33 17.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.117 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -70.52 -31.57 68.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.928 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 t -73.28 -35.35 66.13 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.512 1.133 . . . . 0.0 108.263 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.811 HD22 HD11 ' B' ' 144' ' ' ILE . 45.7 tp -62.14 -52.07 65.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.874 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.822 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -55.78 -36.35 67.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.064 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -82.88 -16.07 48.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.864 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.3 p -67.51 136.38 54.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.867 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 51.9 m -63.11 -52.67 61.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.2 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -117.16 129.29 55.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.953 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -74.46 74.3 1.92 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.878 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.2 p -76.64 151.76 5.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.136 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.2 m -99.68 110.87 23.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.149 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 39.2 p90 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.859 -179.972 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 4.6 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.984 0.421 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -88.64 116.09 26.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.946 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 10.9 ptt? -91.73 167.84 11.89 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.868 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -121.26 136.91 54.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.968 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 103' ' ' ILE . . . . . 0.441 HD13 HG21 ' B' ' 117' ' ' VAL . 46.9 pt -124.85 155.18 33.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.126 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -116.03 115.92 26.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.838 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 105' ' ' VAL . . . . . 0.753 HG21 HD11 ' B' ' 130' ' ' ILE . 98.8 t -96.94 110.34 24.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.101 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -99.29 112.14 24.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.881 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 15.5 p -64.24 169.41 4.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.217 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 27.6 tp -73.61 -8.09 54.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.885 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 30.7 p -93.9 -12.8 28.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.179 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 111.65 -15.64 26.67 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.447 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 19.2 tptt -51.49 139.86 19.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.78 0.324 . . . . 0.0 110.981 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 12.5 m -113.19 104.07 11.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.207 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 113' ' ' ILE . . . . . 0.638 ' CD1' HG23 ' B' ' 130' ' ' ILE . 15.0 mt -100.04 141.78 16.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.151 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 25.9 m -120.34 107.98 13.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.106 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.724 HD13 ' HB2' ' B' ' 129' ' ' LYS . 38.1 mt -124.43 171.64 9.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.906 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -120.51 128.76 53.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.722 HG11 HG22 ' B' ' 126' ' ' VAL . 17.2 m -127.64 -179.61 2.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.101 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -131.01 161.18 63.19 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.614 0.721 . . . . 0.0 110.917 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 -10.73 29.29 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.699 2.266 . . . . 0.0 112.328 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 2.1 p -104.33 -22.01 13.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.871 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -59.17 -175.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.854 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 122' ' ' THR . . . . . 0.648 HG22 HG22 ' B' ' 155' ' ' THR . 22.1 p -133.31 163.04 30.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.155 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 123' ' ' ILE . . . . . 1.016 HG23 HD12 ' B' ' 143' ' ' LEU . 37.8 mm -56.18 -44.15 78.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.14 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -52.69 -33.89 49.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.841 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -66.9 -44.41 80.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.962 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 126' ' ' VAL . . . . . 0.722 HG22 HG11 ' B' ' 117' ' ' VAL . 21.5 t -60.6 -27.87 41.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.147 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 127' ' ' LYS . . . . . 0.585 ' HE3' HG22 ' B' ' 123' ' ' ILE . 93.4 mttt -78.97 -29.47 43.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.891 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -71.38 -30.79 66.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.172 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.724 ' HB2' HD13 ' B' ' 115' ' ' LEU . 0.3 OUTLIER -77.5 -49.32 15.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.858 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 130' ' ' ILE . . . . . 0.753 HD11 HG21 ' B' ' 105' ' ' VAL . 31.8 mt -53.87 -31.04 20.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.154 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -59.23 -36.83 76.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.887 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.84 -12.47 60.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.83 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 133' ' ' LYS . . . . . 0.418 ' HD3' HD21 ' B' ' 115' ' ' LEU . 2.8 mptp? -96.71 -65.86 0.94 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.924 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 134' ' ' GLU . . . . . 0.62 ' CG ' HD11 ' B' ' 113' ' ' ILE . 0.9 OUTLIER -75.96 -45.31 35.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.908 179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.21 19.97 7.74 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.453 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -110.27 144.08 29.38 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.579 0.704 . . . . 0.0 111.124 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 144.27 53.41 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.655 2.237 . . . . 0.0 112.345 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 138' ' ' PRO . . . . . 0.405 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.5 Cg_endo -69.81 -12.87 33.67 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.638 2.225 . . . . 0.0 112.283 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -82.79 -1.38 51.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.909 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -122.18 -37.72 2.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 141' ' ' GLN . . . . . 0.628 ' OE1' HD11 ' B' ' 169' ' ' LEU . 17.7 pt20 -84.95 140.94 30.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.912 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 15.1 mmt85 -122.81 179.88 4.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 143' ' ' LEU . . . . . 1.016 HD12 HG23 ' B' ' 123' ' ' ILE . 11.7 mt -127.51 146.19 50.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.905 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.811 HD11 HD22 ' A' ' 35' ' ' LEU . 24.7 mm -136.9 129.94 45.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.141 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 145' ' ' PHE . . . . . 0.809 ' HB3' HD11 ' B' ' 150' ' ' LEU . 43.0 t80 -169.24 146.16 3.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.878 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 64.79 24.29 12.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.115 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 147' ' ' GLY . . . . . 0.481 ' HA3' HD21 ' A' ' 8' ' ' LEU . . . 65.67 28.8 73.97 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.472 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -141.57 154.37 45.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.742 0.306 . . . . 0.0 110.917 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -81.95 109.51 16.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.945 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.809 HD11 ' HB3' ' B' ' 145' ' ' PHE . 3.6 mt -80.67 125.34 29.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.885 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -139.32 178.84 6.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.9 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.19 -16.55 60.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.818 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.96 -16.88 49.49 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.482 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 16.9 mtt180 -139.71 167.76 21.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.942 0.401 . . . . 0.0 110.808 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 155' ' ' THR . . . . . 0.648 HG22 HG22 ' B' ' 122' ' ' THR . 24.2 p -103.77 179.93 4.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.116 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 156' ' ' LEU . . . . . 0.67 HD13 HD12 ' B' ' 161' ' ' ILE . 4.4 mm? -63.46 -47.88 80.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.95 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 77.8 p -62.96 -17.03 61.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.948 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -71.84 -35.89 70.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.846 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 159' ' ' TYR . . . . . 0.548 ' CG ' HD22 ' B' ' 150' ' ' LEU . 68.8 m-85 -100.62 14.93 29.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.936 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 21.5 t30 51.2 41.74 28.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.938 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 161' ' ' ILE . . . . . 0.67 HD12 HD13 ' B' ' 156' ' ' LEU . 92.2 mt -80.87 104.99 10.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.131 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -93.92 -175.01 3.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.939 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 6.6 tttt -60.56 152.37 26.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.967 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 52.08 53.01 13.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.6 m -93.34 129.16 39.56 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.85 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 166' ' ' THR . . . . . 1.014 HG21 HD12 ' A' ' 25' ' ' LEU . 3.2 m -79.08 84.93 5.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.129 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.725 HD23 ' HB2' ' B' ' 145' ' ' PHE . 7.5 mt -96.98 124.96 41.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.879 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 14.2 m80 -89.57 168.43 12.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.898 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 169' ' ' LEU . . . . . 0.628 HD11 ' OE1' ' B' ' 141' ' ' GLN . 1.5 tp -126.14 143.19 51.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.878 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 170' ' ' VAL . . . . . 0.822 HG13 ' HB2' ' A' ' 36' ' ' ALA . 43.8 t -134.68 119.45 28.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.119 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.58 113.25 26.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.862 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 13.8 ttt-85 -111.31 77.85 1.07 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.811 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 2.0 mp . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.899 -179.959 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.541 ' C ' HD23 ' A' ' 8' ' ' LEU . . . . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.792 0.33 . . . . 0.0 111.135 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.614 HD21 ' O ' ' B' ' 147' ' ' GLY . 0.3 OUTLIER -125.29 164.58 20.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.907 -179.928 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.3 -17.42 10.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.904 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 2.0 m -152.61 127.78 9.79 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.847 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HA ' ' HD2' ' A' ' 12' ' ' PRO . 15.5 t -51.89 107.99 0.96 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.56 0.695 . . . . 0.0 110.892 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.416 ' HD2' ' HA ' ' A' ' 11' ' ' CYS . 53.4 Cg_endo -69.82 -2.87 10.94 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.605 2.203 . . . . 0.0 112.383 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtm -91.64 -54.32 3.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.931 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.8 p -113.29 20.39 16.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.928 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.08 61.13 2.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.915 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.8 ttpt -121.67 107.22 12.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -54.33 118.42 4.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.863 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.447 ' HB3' HD23 ' A' ' 22' ' ' LEU . 41.7 m-85 -70.19 152.6 44.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.891 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.71 148.8 74.25 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.535 0.683 . . . . 0.0 111.088 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 168.96 20.05 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.649 2.233 . . . . 0.0 112.368 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.3 ptt180 39.59 40.5 0.63 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.925 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.447 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -84.72 -176.5 6.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.85 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.45 161.8 28.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.122 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -50.5 -36.27 33.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.8 tt -72.13 -38.95 69.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.911 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 83.2 m-20 -52.97 -50.74 63.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.868 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.429 HG12 ' CD2' ' A' ' 31' ' ' LEU . 19.4 t -66.25 -53.58 35.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.148 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -50.99 -32.77 22.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.873 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.5 m -59.45 -54.93 40.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.859 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -71.42 -34.73 70.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.429 ' CD2' HG12 ' A' ' 27' ' ' VAL . 1.1 mp -53.09 -47.1 68.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.867 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.466 ' HA ' HG21 ' B' ' 170' ' ' VAL . . . -68.24 -33.41 74.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.09 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -73.79 -31.65 63.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.936 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -76.25 -54.63 6.51 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.489 1.118 . . . . 0.0 108.301 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.778 HD22 HG11 ' B' ' 170' ' ' VAL . 5.2 tt -51.26 -57.67 8.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.888 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.895 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -55.46 -32.2 62.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.139 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -78.19 -21.78 49.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 92.5 p -93.92 175.23 6.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.877 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.9 m -124.86 4.37 8.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.186 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -101.32 151.3 22.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.847 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -105.31 57.3 0.68 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.854 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 10.2 p -77.16 149.93 6.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.091 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.9 m -117.0 114.22 23.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.131 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.442 ' HH2' HD12 ' A' ' 35' ' ' LEU . 36.8 p90 . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.96 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 46.4 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.915 0.388 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 6.6 t-80 -133.94 126.16 29.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.851 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.6 ptt? -107.57 170.38 8.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.903 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -123.66 139.64 53.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.925 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 103' ' ' ILE . . . . . 0.45 HG12 HG22 ' B' ' 117' ' ' VAL . 29.0 pt -127.97 170.68 17.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.116 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 104' ' ' PHE . . . . . 0.6 ' CE2' HG23 ' B' ' 114' ' ' THR . 47.9 m-85 -128.91 138.59 52.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.844 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 105' ' ' VAL . . . . . 0.852 HG21 HD11 ' B' ' 130' ' ' ILE . 58.1 t -118.52 111.54 34.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.093 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.52 117.15 33.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.882 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 107' ' ' THR . . . . . 0.593 ' OG1' HG22 ' B' ' 109' ' ' THR . 11.1 p -73.15 172.72 10.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.13 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 15.2 mt -79.46 -1.61 38.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.967 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 109' ' ' THR . . . . . 0.593 HG22 ' OG1' ' B' ' 107' ' ' THR . 14.6 t -90.12 -12.49 38.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.108 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 100.34 14.99 31.34 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.549 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -97.11 145.44 26.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.871 0.367 . . . . 0.0 110.96 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 2.6 m -109.44 137.0 47.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.227 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 62.7 mt -127.53 142.28 44.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.136 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 114' ' ' THR . . . . . 0.6 HG23 ' CE2' ' B' ' 104' ' ' PHE . 1.3 m -119.76 130.86 55.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.115 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.501 HD13 ' HB2' ' B' ' 129' ' ' LYS . 13.6 mt -149.33 171.3 16.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.934 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -110.07 147.99 32.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.904 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.454 HG11 HG22 ' B' ' 126' ' ' VAL . 11.1 m -148.66 179.69 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.127 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -141.88 160.94 53.98 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.589 0.709 . . . . 0.0 110.931 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 -12.8 33.67 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.701 2.267 . . . . 0.0 112.312 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.4 p -99.12 -22.78 15.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.867 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -62.12 -172.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.892 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 122' ' ' THR . . . . . 0.536 ' CG2' HG22 ' B' ' 155' ' ' THR . 1.4 p -133.9 169.46 17.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.075 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 123' ' ' ILE . . . . . 0.74 HG23 HD12 ' B' ' 143' ' ' LEU . 40.8 mm -61.91 -49.06 85.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.152 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -52.51 -35.61 53.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.906 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -60.14 -50.31 74.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.887 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 126' ' ' VAL . . . . . 0.454 HG22 HG11 ' B' ' 117' ' ' VAL . 22.9 t -56.47 -25.09 20.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.146 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -77.42 -27.67 52.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.893 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.22 -30.33 54.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.072 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.501 ' HB2' HD13 ' B' ' 115' ' ' LEU . 0.1 OUTLIER -77.63 -29.03 51.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.83 -179.898 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 130' ' ' ILE . . . . . 0.852 HD11 HG21 ' B' ' 105' ' ' VAL . 46.6 mt -77.39 -28.33 16.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.135 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -53.82 -48.23 70.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.885 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -68.81 -11.78 60.8 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.793 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 133' ' ' LYS . . . . . 0.431 ' HD3' HD21 ' B' ' 115' ' ' LEU . 6.8 mptt -93.09 -66.07 0.95 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.928 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.16 -45.79 17.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.832 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.82 35.67 1.98 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.463 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 136' ' ' ILE . . . . . 0.756 HD13 HD11 ' B' ' 171' ' ' LEU . 0.5 OUTLIER -127.87 142.88 45.73 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.594 0.711 . . . . 0.0 111.131 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 145.64 57.42 Favored 'Trans proline' 0 C--O 1.231 0.132 0 C-N-CA 122.708 2.272 . . . . 0.0 112.302 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 138' ' ' PRO . . . . . 0.415 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 54.0 Cg_endo -69.78 -13.18 34.26 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.724 2.282 . . . . 0.0 112.324 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -82.8 -1.03 50.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.813 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -122.27 -38.12 2.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.924 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 141' ' ' GLN . . . . . 0.502 ' OE1' HD21 ' B' ' 169' ' ' LEU . 14.9 pt20 -83.72 153.88 23.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.913 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 19.0 mmt85 -138.33 179.64 6.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.9 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 143' ' ' LEU . . . . . 0.78 HD22 ' HB3' ' B' ' 167' ' ' LEU . 21.2 mt -129.99 152.43 49.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.893 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.599 HD13 ' O ' ' B' ' 143' ' ' LEU . 23.8 mm -137.24 118.31 17.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.13 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 145' ' ' PHE . . . . . 0.744 ' CB ' HD11 ' B' ' 150' ' ' LEU . 26.2 t80 -155.6 146.89 22.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.879 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 65.41 23.41 11.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.063 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 147' ' ' GLY . . . . . 0.614 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 66.01 29.36 74.84 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.466 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -143.0 154.8 44.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.799 0.333 . . . . 0.0 110.853 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -78.23 109.8 12.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.902 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.744 HD11 ' CB ' ' B' ' 145' ' ' PHE . 5.2 mt -77.25 133.75 38.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.863 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -154.67 173.16 16.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.949 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.89 -25.5 11.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.805 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -50.35 -28.36 13.93 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.51 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 13.9 mtt-85 -137.15 147.58 46.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.884 0.373 . . . . 0.0 110.92 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 155' ' ' THR . . . . . 0.536 HG22 ' CG2' ' B' ' 122' ' ' THR . 30.2 p -82.66 -179.48 7.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.123 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 156' ' ' LEU . . . . . 0.476 HD13 HD12 ' B' ' 161' ' ' ILE . 4.4 mm? -63.07 -47.52 82.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.882 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 27.9 p -59.53 -32.28 70.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.936 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -59.69 -30.86 69.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.843 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -100.61 11.74 38.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.929 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 10.4 t30 51.37 30.33 5.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.903 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 161' ' ' ILE . . . . . 0.476 HD12 HD13 ' B' ' 156' ' ' LEU . 72.1 mt -68.98 110.45 2.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.16 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 61.0 mm-40 -93.34 -169.75 2.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.969 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 32.6 tttt -70.22 155.58 40.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.926 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 51.88 52.06 15.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.868 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.2 p -87.13 152.87 21.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.825 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.5 84.19 1.93 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.123 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.78 ' HB3' HD22 ' B' ' 143' ' ' LEU . 2.5 mt -94.42 140.58 29.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.957 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -93.09 155.57 17.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.867 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 169' ' ' LEU . . . . . 0.54 ' HB3' HG22 ' B' ' 107' ' ' THR . 0.4 OUTLIER -114.64 117.49 31.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 -179.96 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 170' ' ' VAL . . . . . 0.895 HG13 ' HB2' ' A' ' 36' ' ' ALA . 90.6 t -121.98 127.65 75.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.176 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.756 HD11 HD13 ' B' ' 136' ' ' ILE . 0.1 OUTLIER -109.21 119.81 40.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.886 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -111.26 77.85 1.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.839 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 16.6 mt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.917 179.981 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.567 ' C ' HD23 ' A' ' 8' ' ' LEU . . . . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.816 0.341 . . . . 0.0 111.105 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.913 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -143.18 137.62 29.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.935 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -102.24 -3.99 26.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.856 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -148.47 123.8 10.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.854 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HA ' ' HD2' ' A' ' 12' ' ' PRO . 7.9 t -51.68 107.34 0.8 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.575 0.702 . . . . 0.0 110.955 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 11' ' ' CYS . 53.7 Cg_endo -69.74 -2.9 10.94 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.684 2.256 . . . . 0.0 112.318 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 28.1 mtm -92.35 -55.07 3.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.928 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.3 p -110.59 18.2 19.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.881 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 43.79 61.25 2.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.946 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.408 ' HZ1' ' HD1' ' A' ' 18' ' ' PHE . 10.4 ttpt -123.2 111.22 16.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.908 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -59.6 116.48 4.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.854 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.499 ' CE2' HG13 ' A' ' 27' ' ' VAL . 45.4 m-85 -68.26 153.17 44.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.871 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.4 ' O ' HD23 ' A' ' 22' ' ' LEU . . . -58.38 150.26 55.36 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.598 0.713 . . . . 0.0 111.059 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 169.21 19.4 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.665 2.243 . . . . 0.0 112.38 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.8 ptt85 39.94 39.66 0.62 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.897 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.425 ' C ' HD12 ' A' ' 22' ' ' LEU . 0.8 OUTLIER -83.8 -176.4 6.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.922 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.3 p -129.25 162.55 27.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.206 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -51.89 -34.27 40.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.892 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.516 ' O ' HD13 ' A' ' 25' ' ' LEU . 0.3 OUTLIER -72.26 -32.91 67.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.938 179.992 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -61.3 -55.79 27.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.839 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.499 HG13 ' CE2' ' A' ' 18' ' ' PHE . 98.4 t -64.89 -32.45 58.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.137 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -71.41 -34.21 70.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.828 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 75.6 m -61.39 -53.84 51.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.869 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -69.75 -40.52 76.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.859 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.913 HD11 HD11 ' A' ' 8' ' ' LEU . 11.4 mt -52.09 -50.02 62.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.901 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.424 ' HB2' ' HB3' ' B' ' 168' ' ' HIS . . . -52.97 -50.71 63.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.086 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -62.36 -52.05 65.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.921 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -38.93 64.97 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.526 1.141 . . . . 0.0 108.334 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.685 ' HB3' HG11 ' B' ' 170' ' ' VAL . 0.4 OUTLIER -56.24 -58.34 8.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.907 179.945 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.832 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -57.75 -29.86 65.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.088 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -93.1 7.19 45.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.905 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 t -82.25 129.74 34.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.904 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 17.6 p -67.79 -24.44 65.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.105 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -139.64 128.09 22.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.855 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -81.36 83.35 6.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.872 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.8 m -99.22 173.28 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.128 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.1 m -122.3 128.17 50.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.19 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 41.2 p90 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.001 179.928 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.927 0.394 . . . . 0.0 110.868 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 6.7 p-80 -117.99 -175.35 2.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.833 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 7.4 ptt? -98.58 173.56 6.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.838 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -123.67 157.19 34.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.904 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 103' ' ' ILE . . . . . 0.53 HD13 HG21 ' B' ' 117' ' ' VAL . 31.7 pt -143.49 163.28 16.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.109 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -123.18 115.88 22.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.871 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 105' ' ' VAL . . . . . 0.887 HG21 HD11 ' B' ' 130' ' ' ILE . 44.7 t -104.87 120.04 54.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.128 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -112.24 140.43 46.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 107' ' ' THR . . . . . 0.666 HG22 HD22 ' B' ' 169' ' ' LEU . 43.9 p -94.61 -179.25 4.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.137 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 108' ' ' LEU . . . . . 0.546 HD13 ' O ' ' B' ' 169' ' ' LEU . 6.1 mp -78.1 -3.47 42.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.866 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 29.6 p -90.45 -1.74 57.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.183 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 92.69 -19.91 48.2 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.389 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 14.2 ttmm -61.16 139.32 58.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.835 0.35 . . . . 0.0 110.949 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 4.7 m -112.57 125.33 54.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.154 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 51.6 mt -110.0 142.47 22.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.151 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 29.1 m -124.15 107.56 11.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.189 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.774 HD13 ' HG3' ' B' ' 129' ' ' LYS . 11.6 mt -127.28 165.41 19.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.907 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -102.28 144.31 30.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.862 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.581 HG11 HG22 ' B' ' 126' ' ' VAL . 10.9 m -140.76 153.84 21.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.157 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -99.51 156.23 35.62 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.706 0.765 . . . . 0.0 110.907 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.82 -13.88 35.13 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.666 2.244 . . . . 0.0 112.341 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 84.3 p -105.07 -9.33 17.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.918 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.425 ' C ' HD23 ' B' ' 156' ' ' LEU . 58.0 m-20 -68.16 -174.6 0.51 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.867 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 122' ' ' THR . . . . . 0.611 HG22 HG22 ' B' ' 155' ' ' THR . 24.2 p -132.45 175.18 9.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.175 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 123' ' ' ILE . . . . . 0.832 HG22 ' HE3' ' B' ' 127' ' ' LYS . 32.7 mm -62.79 -46.84 95.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.091 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -53.94 -32.77 54.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.876 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.24 -43.13 82.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.914 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 126' ' ' VAL . . . . . 0.581 HG22 HG11 ' B' ' 117' ' ' VAL . 42.6 t -56.18 -36.27 45.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.23 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 127' ' ' LYS . . . . . 0.832 ' HE3' HG22 ' B' ' 123' ' ' ILE . 40.0 mttt -78.79 -28.65 44.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.869 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.74 -51.88 67.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.049 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.774 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -71.33 -37.95 71.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.912 179.963 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 130' ' ' ILE . . . . . 0.887 HD11 HG21 ' B' ' 105' ' ' VAL . 57.3 mt -57.92 -29.18 35.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.136 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -57.27 -47.5 81.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.859 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -69.5 -11.49 60.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.828 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 133' ' ' LYS . . . . . 0.549 ' CE ' HD21 ' B' ' 115' ' ' LEU . 12.0 mptt -88.72 -66.49 0.91 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.844 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -83.34 -45.32 13.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.858 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 111.28 41.77 1.13 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.445 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 136' ' ' ILE . . . . . 0.489 HD13 HD11 ' B' ' 171' ' ' LEU . 0.7 OUTLIER -133.82 142.15 42.56 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.61 0.719 . . . . 0.0 111.092 -179.987 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 144.32 53.4 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.732 2.288 . . . . 0.0 112.297 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.84 -12.92 33.7 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.695 2.263 . . . . 0.0 112.269 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -83.0 -0.58 49.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.885 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -120.95 -38.4 2.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.87 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 141' ' ' GLN . . . . . 0.646 ' OE1' HD11 ' B' ' 169' ' ' LEU . 18.2 pt20 -83.62 154.2 23.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.972 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 41.5 mtt85 -135.53 174.78 10.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.839 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 143' ' ' LEU . . . . . 0.793 HD23 HD12 ' B' ' 150' ' ' LEU . 6.7 tp -121.83 153.96 37.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.894 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.556 HD13 ' O ' ' B' ' 143' ' ' LEU . 30.8 mm -139.62 108.33 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.094 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 145' ' ' PHE . . . . . 0.784 ' HB2' HD23 ' B' ' 167' ' ' LEU . 23.6 t80 -144.87 146.28 31.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.859 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 64.07 23.4 13.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.099 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 147' ' ' GLY . . . . . 0.626 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 72.73 6.07 65.99 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.488 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.6 155.52 36.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.72 0.295 . . . . 0.0 110.897 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -83.68 111.78 19.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.899 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.793 HD12 HD23 ' B' ' 143' ' ' LEU . 1.6 mt -79.16 135.63 36.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.915 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -139.88 177.58 7.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.884 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -63.24 -16.98 61.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.822 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.4 -17.29 46.65 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.483 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 8.4 mtt180 -136.85 167.51 21.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.827 0.346 . . . . 0.0 110.898 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 155' ' ' THR . . . . . 0.611 HG22 HG22 ' B' ' 122' ' ' THR . 74.0 p -103.17 -179.7 4.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.073 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 156' ' ' LEU . . . . . 0.791 HD13 HD12 ' B' ' 161' ' ' ILE . 4.5 mm? -65.37 -47.86 74.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.953 179.922 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 16.1 t -65.7 -18.27 65.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.838 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.23 -31.18 63.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.847 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 159' ' ' TYR . . . . . 0.505 ' CG ' HD22 ' B' ' 150' ' ' LEU . 33.3 m-85 -100.4 13.42 34.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.932 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 17.0 t30 50.82 43.74 28.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.877 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 161' ' ' ILE . . . . . 0.791 HD12 HD13 ' B' ' 156' ' ' LEU . 92.1 mt -82.22 108.3 15.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.135 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -89.34 178.51 6.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.894 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 30.5 tttm -64.84 150.93 46.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.884 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 59.49 34.85 22.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.96 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.8 m -75.9 135.23 40.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.88 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.51 110.15 22.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.059 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.784 HD23 ' HB2' ' B' ' 145' ' ' PHE . 0.5 OUTLIER -121.75 155.54 35.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.882 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 168' ' ' HIS . . . . . 0.424 ' HB3' ' HB2' ' A' ' 32' ' ' ALA . 1.1 m80 -103.18 151.16 22.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.829 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 169' ' ' LEU . . . . . 0.666 HD22 HG22 ' B' ' 107' ' ' THR . 3.4 tp -109.61 147.57 32.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.891 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 170' ' ' VAL . . . . . 0.832 HG13 ' HB2' ' A' ' 36' ' ' ALA . 25.3 t -142.95 126.43 14.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.153 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.489 HD11 HD13 ' B' ' 136' ' ' ILE . 0.4 OUTLIER -106.22 119.8 40.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.925 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.15 77.85 1.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.829 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 12.4 mt . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.898 -179.985 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.451 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.853 0.358 . . . . 0.0 111.063 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.935 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -139.74 157.37 45.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.876 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -123.46 10.22 9.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.839 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.3 m -154.49 119.26 4.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.854 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 35.1 t -51.31 107.25 0.78 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.569 0.699 . . . . 0.0 110.879 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.408 ' HD2' HD21 ' A' ' 31' ' ' LEU . 53.0 Cg_endo -69.77 -2.51 10.31 Favored 'Trans proline' 0 N--CA 1.465 -0.188 0 C-N-CA 122.693 2.262 . . . . 0.0 112.348 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.4 ttm -91.45 -53.76 4.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.875 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.3 p -116.08 21.55 13.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.898 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.04 67.54 0.62 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.939 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 tppt? -124.41 107.71 11.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.877 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -59.23 112.1 1.59 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.839 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.68 ' CE2' HG13 ' A' ' 27' ' ' VAL . 41.5 m-85 -64.59 152.81 41.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.84 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -71.66 148.23 92.56 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.521 0.677 . . . . 0.0 111.114 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 167.97 22.95 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.626 2.217 . . . . 0.0 112.335 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 60.46 17.74 7.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.459 ' C ' HD12 ' A' ' 22' ' ' LEU . 0.6 OUTLIER -76.8 -174.9 3.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.949 -179.986 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.2 p -139.8 169.9 16.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.181 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -52.2 -34.36 45.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.895 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 13.8 tp -72.19 -31.9 66.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.899 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.57 -60.54 3.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.872 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.68 HG13 ' CE2' ' A' ' 18' ' ' PHE . 21.0 t -57.15 -36.51 51.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.153 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -71.65 -41.01 69.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.876 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.5 m -51.54 -53.79 34.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.897 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -68.52 -49.98 55.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.893 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.935 HD11 HD11 ' A' ' 8' ' ' LEU . 12.6 mt -53.12 -25.54 13.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.874 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.08 -49.85 33.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.124 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -30.98 63.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.937 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.6 t -71.37 -23.08 61.83 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.454 1.096 . . . . 0.0 108.325 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 45.3 tp -84.93 -50.06 7.82 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.907 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.997 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -66.94 -15.9 63.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.071 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.32 -25.38 14.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.903 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 56.7 p -72.54 168.2 19.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.862 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.43 4.13 13.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.192 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -117.72 159.17 23.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.885 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -124.77 65.17 1.11 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.906 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 20.7 m -89.53 133.97 30.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.188 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.0 m -99.7 119.74 38.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.159 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.472 ' HZ2' HD13 ' A' ' 31' ' ' LEU . 36.8 p90 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.909 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.899 0.38 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -116.33 114.31 24.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.893 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.7 ptt? -96.07 164.73 12.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.899 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -115.29 158.95 21.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.968 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 22.8 pt -149.76 155.25 8.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.122 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -121.95 141.25 51.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.934 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 105' ' ' VAL . . . . . 0.812 HG11 HD23 ' B' ' 169' ' ' LEU . 93.1 t -131.58 113.58 23.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.161 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -99.26 132.91 44.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 107' ' ' THR . . . . . 0.41 HG22 ' HB3' ' B' ' 169' ' ' LEU . 68.0 p -87.44 175.75 7.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.099 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 13.6 mt -73.74 -10.3 59.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.902 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 24.4 p -90.38 -12.72 36.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.066 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 107.59 -14.72 38.65 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.464 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 2.9 ttmp? -51.8 148.29 5.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.966 0.412 . . . . 0.0 110.893 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 23.1 m -125.69 104.07 8.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.177 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 57.0 mt -96.93 141.99 14.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.146 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 90.6 m -130.05 108.83 10.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.21 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.681 HD13 ' HG3' ' B' ' 129' ' ' LYS . 13.8 mt -130.18 170.48 14.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.83 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -114.43 148.14 38.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.845 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.776 HG11 HG22 ' B' ' 126' ' ' VAL . 11.0 m -140.12 178.75 3.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.174 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -122.05 160.57 46.78 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.58 0.705 . . . . 0.0 110.886 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 -20.68 34.18 Favored 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.686 2.258 . . . . 0.0 112.299 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 57.4 m -96.83 -6.92 34.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.858 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -73.0 -175.78 1.88 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.918 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 122' ' ' THR . . . . . 0.493 ' CG2' HG22 ' B' ' 155' ' ' THR . 5.2 p -135.07 164.34 27.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.189 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 123' ' ' ILE . . . . . 0.823 HG22 ' HE2' ' B' ' 127' ' ' LYS . 38.2 mm -54.27 -38.8 40.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.149 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -60.77 -35.78 77.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.907 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.03 -41.88 94.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.857 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 126' ' ' VAL . . . . . 0.776 HG22 HG11 ' B' ' 117' ' ' VAL . 23.9 t -56.74 -38.4 58.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.072 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 127' ' ' LYS . . . . . 0.823 ' HE2' HG22 ' B' ' 123' ' ' ILE . 25.0 mttm -78.21 -28.94 48.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.76 -51.67 68.0 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.15 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.681 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -72.19 -39.23 68.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.935 179.919 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 130' ' ' ILE . . . . . 0.446 ' CG1' HD12 ' B' ' 115' ' ' LEU . 55.9 mt -57.02 -29.58 31.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.146 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -56.39 -46.13 80.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.925 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -69.72 -11.69 61.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.81 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 133' ' ' LYS . . . . . 0.559 ' HD3' HD11 ' B' ' 115' ' ' LEU . 10.0 mptt -89.61 -66.26 0.94 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.898 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 134' ' ' GLU . . . . . 0.429 ' OE1' HD12 ' B' ' 136' ' ' ILE . 1.1 tm-20 -81.81 -45.49 15.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.898 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.69 37.34 1.74 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.533 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 136' ' ' ILE . . . . . 0.627 HD13 HD11 ' B' ' 171' ' ' LEU . 0.6 OUTLIER -129.37 142.22 44.49 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.631 0.729 . . . . 0.0 111.184 179.982 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 144.36 53.65 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.61 2.206 . . . . 0.0 112.35 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 138' ' ' PRO . . . . . 0.406 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.6 Cg_endo -69.77 -14.64 36.33 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.724 2.283 . . . . 0.0 112.312 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -81.57 -0.71 43.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.857 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -121.49 -37.59 2.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.961 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 141' ' ' GLN . . . . . 0.467 ' HB2' HD11 ' B' ' 169' ' ' LEU . 18.7 pt20 -85.43 155.02 21.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.913 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 45.5 mtt180 -139.06 -178.67 5.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.902 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 143' ' ' LEU . . . . . 0.804 HD12 HG23 ' B' ' 123' ' ' ILE . 13.2 mt -130.0 153.98 47.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.539 HD13 ' O ' ' B' ' 143' ' ' LEU . 22.0 mm -136.14 119.31 22.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.066 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 145' ' ' PHE . . . . . 0.819 ' HB3' HD11 ' B' ' 150' ' ' LEU . 5.1 t80 -153.48 146.38 24.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.874 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 65.45 28.81 11.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.132 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 147' ' ' GLY . . . . . 0.691 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 69.62 8.88 60.91 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.505 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.36 159.98 37.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.665 0.269 . . . . 0.0 110.926 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.87 128.44 34.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.87 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.819 HD11 ' HB3' ' B' ' 145' ' ' PHE . 5.1 mt -96.93 130.06 44.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.926 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -131.12 178.56 6.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.88 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.74 -16.86 59.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.918 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -55.28 -22.73 31.09 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.464 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 6.0 mtp85 -137.22 167.9 20.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.906 0.384 . . . . 0.0 110.821 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 155' ' ' THR . . . . . 0.493 HG22 ' CG2' ' B' ' 122' ' ' THR . 64.1 p -99.19 -179.6 4.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.157 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 156' ' ' LEU . . . . . 0.621 HD12 HG21 ' B' ' 161' ' ' ILE . 3.7 mm? -65.06 -44.61 88.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.907 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 11.0 p -67.46 -18.31 65.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.894 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -76.84 -30.92 56.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.915 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 159' ' ' TYR . . . . . 0.591 ' CG ' HD22 ' B' ' 150' ' ' LEU . 27.7 m-85 -100.74 15.97 26.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.937 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 13.2 t30 57.88 34.21 24.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.905 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 161' ' ' ILE . . . . . 0.621 HG21 HD12 ' B' ' 156' ' ' LEU . 28.1 mm -68.93 109.08 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.183 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 81.1 mm-40 -101.24 173.47 6.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.955 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -61.02 140.38 57.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.868 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 58.63 48.93 11.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.879 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 3.3 m -82.96 137.92 34.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.872 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.67 96.63 8.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.148 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.589 ' HB3' HD22 ' B' ' 143' ' ' LEU . 6.0 mt -107.63 172.12 7.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.878 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 168' ' ' HIS . . . . . 0.492 ' O ' HD23 ' B' ' 143' ' ' LEU . 35.5 m-70 -132.39 170.06 15.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.846 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 169' ' ' LEU . . . . . 0.812 HD23 HG11 ' B' ' 105' ' ' VAL . 0.2 OUTLIER -121.57 119.11 30.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.952 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 170' ' ' VAL . . . . . 0.997 HG13 ' HB2' ' A' ' 36' ' ' ALA . 23.6 t -125.36 114.81 41.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.119 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.627 HD11 HD13 ' B' ' 136' ' ' ILE . 0.2 OUTLIER -99.76 119.36 38.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.94 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -111.13 77.96 1.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.861 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 9.0 mt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.848 -179.956 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.438 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.835 0.35 . . . . 0.0 111.082 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.958 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -134.29 129.83 36.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.893 -179.923 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.45 4.45 52.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.9 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.5 m -154.53 126.63 7.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.934 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HA ' ' HD2' ' A' ' 12' ' ' PRO . 11.2 t -52.14 108.23 1.03 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.693 0.759 . . . . 0.0 110.903 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.43 ' HD2' ' HA ' ' A' ' 11' ' ' CYS . 53.0 Cg_endo -69.86 -0.73 7.42 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.623 2.215 . . . . 0.0 112.298 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -96.26 -54.04 3.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.868 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.9 p -114.39 22.23 13.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.916 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.5 tp60 41.46 68.18 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.866 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.1 tppt? -125.08 103.88 8.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.911 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -56.31 107.99 0.43 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.881 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.687 ' CE2' HG13 ' A' ' 27' ' ' VAL . 36.2 m-85 -63.22 153.08 35.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.823 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.48 150.45 34.25 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.59 0.71 . . . . 0.0 111.067 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 168.6 21.22 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.642 2.228 . . . . 0.0 112.352 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 39.73 40.47 0.67 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.86 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.422 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -84.16 -176.49 6.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.967 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.9 p -129.46 164.4 23.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.107 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -52.35 -31.44 33.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.865 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.8 tp -71.92 -33.83 68.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.858 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.88 -59.51 4.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.871 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.687 HG13 ' CE2' ' A' ' 18' ' ' PHE . 21.7 t -57.59 -37.09 56.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.229 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -71.76 -36.29 70.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.878 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.6 m -54.92 -54.02 48.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.872 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 -72.54 -43.12 63.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.87 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.958 HD11 HD11 ' A' ' 8' ' ' LEU . 13.5 mt -51.91 -31.81 30.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.883 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.34 -38.81 65.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.11 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -74.27 -45.58 46.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -53.1 -52.19 59.43 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.512 1.132 . . . . 0.0 108.271 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.657 HD12 HD11 ' B' ' 144' ' ' ILE . 17.0 mt -52.52 -56.21 16.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.911 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.817 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -57.94 -22.19 47.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.074 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -102.98 8.9 38.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.871 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.6 m -116.7 167.07 11.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.879 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.8 m -124.35 -33.54 3.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.142 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -51.16 -56.1 14.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.843 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 t0 63.72 54.49 1.82 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.899 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 29.4 m -81.64 165.11 2.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.128 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 6.1 m -115.01 117.07 29.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.095 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 33.5 p90 . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.972 179.93 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.864 0.364 . . . . 0.0 110.863 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -167.99 122.25 0.95 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.91 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 101' ' ' MET . . . . . 0.486 ' HE2' HG23 ' B' ' 117' ' ' VAL . 5.6 ptt? -100.69 170.73 8.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.903 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -119.84 141.72 49.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.934 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 103' ' ' ILE . . . . . 0.651 HD13 HG21 ' B' ' 117' ' ' VAL . 42.1 pt -134.43 164.86 33.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.094 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -122.43 149.11 44.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.876 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 105' ' ' VAL . . . . . 0.583 HG21 HD11 ' B' ' 130' ' ' ILE . 61.6 t -136.84 117.6 17.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.137 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.22 155.49 17.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.83 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 107' ' ' THR . . . . . 0.553 HG22 HD22 ' B' ' 169' ' ' LEU . 61.8 p -112.86 170.06 8.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.143 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 108' ' ' LEU . . . . . 0.408 HD11 ' CB ' ' A' ' 36' ' ' ALA . 63.7 mt -64.83 -15.8 62.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.937 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 24.0 p -90.43 -12.55 37.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.091 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 104.22 -8.98 49.57 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.508 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 8.6 ttmm -51.75 142.39 14.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.912 0.387 . . . . 0.0 110.881 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 27.8 m -112.34 106.42 14.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.157 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 71.8 mt -100.68 141.79 16.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.207 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 31.6 m -129.25 122.62 30.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.187 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.613 HD21 ' HE2' ' B' ' 133' ' ' LYS . 12.8 mt -144.49 170.57 15.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.883 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -109.77 151.31 27.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.917 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.651 HG21 HD13 ' B' ' 103' ' ' ILE . 4.1 m -146.7 174.71 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.098 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -122.15 161.32 43.45 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.621 0.724 . . . . 0.0 110.873 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 -9.21 25.52 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.712 2.275 . . . . 0.0 112.315 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 13.0 m -103.5 -19.35 14.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.861 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -59.34 -174.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.876 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 122' ' ' THR . . . . . 0.907 HG22 HG22 ' B' ' 155' ' ' THR . 59.2 p -142.13 172.87 12.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.105 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 123' ' ' ILE . . . . . 1.058 HG23 HD12 ' B' ' 143' ' ' LEU . 28.1 mm -58.35 -35.52 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.167 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -74.7 -25.02 58.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.876 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -74.45 -50.37 18.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.868 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 126' ' ' VAL . . . . . 0.411 HG23 HD11 ' B' ' 103' ' ' ILE . 2.4 p -56.59 -33.39 39.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.096 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -77.69 -28.46 51.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.945 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.49 -52.57 64.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.098 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.41 ' HD3' ' HA ' ' B' ' 126' ' ' VAL . 0.0 OUTLIER -70.98 -30.69 67.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 179.967 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 130' ' ' ILE . . . . . 0.583 HD11 HG21 ' B' ' 105' ' ' VAL . 47.5 mt -63.63 -29.37 47.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.082 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -58.15 -42.69 86.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.88 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -69.73 -11.44 60.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.872 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 133' ' ' LYS . . . . . 0.613 ' HE2' HD21 ' B' ' 115' ' ' LEU . 2.1 mptp? -90.92 -65.7 0.99 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.872 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -82.12 -45.48 15.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.911 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.3 42.35 1.18 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.472 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 136' ' ' ILE . . . . . 0.711 HD13 HD11 ' B' ' 171' ' ' LEU . 0.5 OUTLIER -136.78 143.1 41.3 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.688 0.756 . . . . 0.0 111.101 -179.976 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 144.79 55.33 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.707 2.272 . . . . 0.0 112.342 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 138' ' ' PRO . . . . . 0.405 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.8 Cg_endo -69.78 -12.74 33.47 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.693 2.262 . . . . 0.0 112.365 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -83.53 -0.3 49.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.869 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -119.6 -39.42 2.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.966 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 141' ' ' GLN . . . . . 0.405 ' HG2' ' HA ' ' B' ' 138' ' ' PRO . 19.5 pt20 -80.29 147.74 31.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.927 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -121.74 -178.46 3.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.89 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 143' ' ' LEU . . . . . 1.058 HD12 HG23 ' B' ' 123' ' ' ILE . 12.1 mt -136.39 147.98 47.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.918 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.677 HD13 ' O ' ' B' ' 143' ' ' LEU . 17.2 mm -134.0 125.71 49.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.126 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 145' ' ' PHE . . . . . 0.738 ' HB2' HD11 ' B' ' 150' ' ' LEU . 4.9 t80 -155.81 143.3 19.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.887 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 59.1 26.37 15.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.128 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 147' ' ' GLY . . . . . 0.643 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 71.89 9.54 70.9 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.45 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.87 151.37 40.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.785 0.326 . . . . 0.0 110.877 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -82.92 109.96 17.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.959 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.738 HD11 ' HB2' ' B' ' 145' ' ' PHE . 4.5 mt -75.86 132.69 40.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.944 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -128.25 159.44 35.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.906 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -53.29 -26.7 19.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.886 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -52.05 -25.92 18.49 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.502 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -118.37 167.64 11.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.896 0.379 . . . . 0.0 110.925 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 155' ' ' THR . . . . . 0.907 HG22 HG22 ' B' ' 122' ' ' THR . 65.0 p -110.57 -179.4 3.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.13 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 156' ' ' LEU . . . . . 0.591 HD13 HD12 ' B' ' 161' ' ' ILE . 3.7 mm? -64.28 -41.1 97.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.942 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 38.2 t -67.25 -19.73 65.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.859 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -75.42 -35.88 60.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 159' ' ' TYR . . . . . 0.415 ' CG ' HD22 ' B' ' 150' ' ' LEU . 40.5 m-85 -100.47 8.44 43.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.958 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 10.2 t30 51.23 45.02 28.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.916 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 161' ' ' ILE . . . . . 0.591 HD12 HD13 ' B' ' 156' ' ' LEU . 87.9 mt -78.98 105.31 8.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.098 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 64.7 mm-40 -89.62 -169.59 2.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.957 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 29.4 tttt -70.26 155.9 40.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.92 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 51.98 52.23 14.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.894 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.4 p -91.29 132.63 36.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.92 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 5.5 m -87.04 84.49 7.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.118 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.616 ' HB3' HD22 ' B' ' 143' ' ' LEU . 6.1 mt -97.92 134.71 40.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 56.5 m-70 -99.14 143.26 29.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.862 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 169' ' ' LEU . . . . . 0.9 HD21 HD12 ' B' ' 171' ' ' LEU . 2.2 tt -103.61 140.85 37.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.89 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 170' ' ' VAL . . . . . 0.817 HG13 ' HB2' ' A' ' 36' ' ' ALA . 11.4 t -138.57 111.17 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.08 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.9 HD12 HD21 ' B' ' 169' ' ' LEU . 0.1 OUTLIER -86.95 119.6 27.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.919 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 12.6 tpp85 -111.64 77.37 1.04 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.831 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 8.0 mp . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.861 -179.991 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.423 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.871 0.367 . . . . 0.0 111.121 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.64 HD12 ' HE2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -138.17 145.81 41.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.93 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.56 -1.54 21.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.842 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -154.29 123.25 6.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.886 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.9 t -51.24 106.58 0.67 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.594 0.711 . . . . 0.0 110.873 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.7 -3.8 12.71 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.703 2.269 . . . . 0.0 112.375 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.0 mtt -89.03 -54.82 3.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.86 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.0 p -113.91 19.49 16.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.955 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 44.44 67.19 0.72 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.853 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 tppt? -124.02 111.71 16.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.816 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -64.76 120.75 13.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.896 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.64 ' HE2' HD12 ' A' ' 8' ' ' LEU . 39.8 m-85 -75.77 153.28 37.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.868 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.39 152.19 45.12 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.564 0.697 . . . . 0.0 111.074 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 170.3 16.82 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.678 2.252 . . . . 0.0 112.335 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.6 39.04 0.46 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.901 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.543 HD22 HG22 ' A' ' 27' ' ' VAL . 0.5 OUTLIER -83.47 -179.12 7.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.864 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -125.76 163.95 21.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.078 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -51.29 -37.15 45.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.909 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.455 ' O ' HD13 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -71.59 -40.06 70.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.922 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -53.6 -46.4 70.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.885 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.624 HG13 ' CE2' ' A' ' 18' ' ' PHE . 11.8 t -71.28 -55.84 12.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.113 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.512 ' HA ' HD22 ' A' ' 31' ' ' LEU . 37.1 m-20 -51.43 -32.67 27.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.817 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.3 m -54.53 -54.63 38.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.84 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 27.6 t-80 -70.15 -35.25 73.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.925 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.634 HD21 HD11 ' A' ' 8' ' ' LEU . 0.4 OUTLIER -53.89 -44.47 70.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.907 179.974 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.51 -33.72 76.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.048 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -73.82 -53.1 11.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.935 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -53.49 -56.96 12.6 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.5 1.125 . . . . 0.0 108.327 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.751 ' HG ' HG11 ' B' ' 170' ' ' VAL . 24.8 tp -52.34 -48.79 65.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.998 -1.001 . . . . 0.0 110.909 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.652 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -62.09 -22.04 65.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.115 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -99.39 -2.52 36.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.896 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -112.05 157.13 21.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.856 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.0 p -107.83 4.22 25.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.159 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -110.44 103.94 12.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.91 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -80.0 62.88 4.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.801 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.5 p -77.93 145.28 10.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.106 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 33.0 m -99.74 111.0 23.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.143 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 38.3 p90 . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.895 -179.997 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 5.3 m . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.907 0.384 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -134.66 -81.09 0.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.906 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -172.13 155.83 3.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.847 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -109.18 147.41 32.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.989 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 103' ' ' ILE . . . . . 0.49 HD13 HG21 ' B' ' 117' ' ' VAL . 44.4 pt -139.76 155.24 24.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.099 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -120.24 141.4 49.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.891 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 105' ' ' VAL . . . . . 0.578 HG21 HD11 ' B' ' 130' ' ' ILE . 39.0 t -129.0 125.64 63.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.067 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.23 154.23 18.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.917 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 39.5 p -111.54 175.24 5.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.093 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 108' ' ' LEU . . . . . 0.524 HD11 ' CB ' ' A' ' 36' ' ' ALA . 12.8 mt -71.55 -12.94 61.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.878 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 49.1 p -90.43 -12.62 36.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.156 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 102.7 -15.12 56.03 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.501 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 19.0 ttmt -51.74 155.22 1.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.885 0.374 . . . . 0.0 110.848 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 54.9 m -118.83 107.48 13.67 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.095 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 63.7 mt -97.11 141.89 14.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.142 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 11.6 m -129.2 131.2 47.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.161 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.818 HD13 ' HG3' ' B' ' 129' ' ' LYS . 17.8 mt -150.13 170.43 18.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.915 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -109.78 148.58 31.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.897 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.574 HG11 HG22 ' B' ' 126' ' ' VAL . 23.8 m -148.65 169.22 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.128 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -113.09 157.65 40.21 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.711 0.767 . . . . 0.0 110.825 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -10.39 28.38 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.667 2.245 . . . . 0.0 112.372 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 14.8 m -107.33 -13.05 15.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.834 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -63.86 -175.21 0.13 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.875 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 122' ' ' THR . . . . . 0.475 HG22 HG22 ' B' ' 155' ' ' THR . 21.6 p -132.1 165.99 22.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.121 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 123' ' ' ILE . . . . . 0.875 HG23 HD12 ' B' ' 143' ' ' LEU . 37.9 mm -57.51 -41.06 78.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.113 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -57.56 -33.23 67.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.872 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.52 -42.44 74.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.864 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 126' ' ' VAL . . . . . 0.574 HG22 HG11 ' B' ' 117' ' ' VAL . 36.1 t -56.67 -35.52 45.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.147 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 127' ' ' LYS . . . . . 0.793 ' HE2' HG22 ' B' ' 123' ' ' ILE . 34.3 mttm -78.56 -28.7 45.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.909 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.56 -51.88 66.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.064 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.818 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -71.57 -39.88 70.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.942 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 130' ' ' ILE . . . . . 0.578 HD11 HG21 ' B' ' 105' ' ' VAL . 51.6 mt -53.68 -29.92 18.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.114 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -60.78 -41.49 95.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.925 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -68.81 -11.49 60.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.819 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 133' ' ' LYS . . . . . 0.525 ' HD3' HD21 ' B' ' 115' ' ' LEU . 0.1 OUTLIER -93.86 -66.12 0.94 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.905 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -80.5 -46.44 15.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.863 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.27 35.03 2.19 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.495 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 136' ' ' ILE . . . . . 0.776 HD13 HD11 ' B' ' 171' ' ' LEU . 0.7 OUTLIER -124.97 142.07 40.11 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.579 0.704 . . . . 0.0 111.107 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.86 144.59 53.98 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.619 2.213 . . . . 0.0 112.338 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 138' ' ' PRO . . . . . 0.401 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 54.1 Cg_endo -69.77 -13.06 34.11 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.705 2.27 . . . . 0.0 112.36 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -82.62 -1.45 51.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.896 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -122.25 -38.14 2.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.9 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 141' ' ' GLN . . . . . 0.564 ' OE1' HD21 ' B' ' 169' ' ' LEU . 12.5 pt20 -83.38 153.66 24.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.908 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 29.0 mtt-85 -137.03 179.56 6.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.852 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 143' ' ' LEU . . . . . 0.875 HD12 HG23 ' B' ' 123' ' ' ILE . 13.0 mt -128.04 152.4 47.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.855 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.555 HD13 ' O ' ' B' ' 143' ' ' LEU . 23.7 mm -138.61 111.14 6.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.095 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 145' ' ' PHE . . . . . 0.726 ' HB3' HD11 ' B' ' 150' ' ' LEU . 4.2 t80 -146.35 145.43 30.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.854 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 63.93 24.37 13.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.083 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 68.68 28.35 73.2 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.467 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -143.99 154.3 43.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.791 0.329 . . . . 0.0 110.905 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -84.46 109.7 18.1 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.857 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.726 HD11 ' HB3' ' B' ' 145' ' ' PHE . 3.8 mt -81.31 131.39 35.29 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.919 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -137.99 -179.66 5.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.95 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.02 -16.57 60.28 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.829 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -58.87 -19.01 42.14 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.512 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 14.1 mtp85 -140.31 167.79 21.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.859 0.361 . . . . 0.0 110.882 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 155' ' ' THR . . . . . 0.475 HG22 HG22 ' B' ' 122' ' ' THR . 41.4 p -101.2 -179.86 4.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.211 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 156' ' ' LEU . . . . . 0.64 HD12 HG21 ' B' ' 161' ' ' ILE . 3.7 mm? -64.06 -47.61 79.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.944 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 8.5 p -65.48 -16.29 63.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.842 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.44 -32.54 58.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.824 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 159' ' ' TYR . . . . . 0.714 ' CG ' HD22 ' B' ' 150' ' ' LEU . 33.0 m-85 -100.7 16.05 26.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.895 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 8.2 t30 59.08 34.97 23.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.898 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 161' ' ' ILE . . . . . 0.64 HG21 HD12 ' B' ' 156' ' ' LEU . 28.9 mm -68.61 104.22 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.151 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -96.42 175.63 6.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.895 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 38.1 tttt -60.5 141.82 56.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.883 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 63.99 35.95 10.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.858 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 165' ' ' SER . . . . . 0.418 ' HB3' HD11 ' B' ' 167' ' ' LEU . 1.5 m -67.68 128.95 38.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.814 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 166' ' ' THR . . . . . 0.404 ' CG2' HD21 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -93.26 96.31 9.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.145 179.986 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.634 ' HB3' HD22 ' B' ' 143' ' ' LEU . 4.9 mp -106.76 166.76 10.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.949 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 168' ' ' HIS . . . . . 0.461 ' O ' HD23 ' B' ' 143' ' ' LEU . 78.2 m80 -115.59 169.9 8.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.933 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 169' ' ' LEU . . . . . 0.598 HD13 ' N ' ' B' ' 170' ' ' VAL . 0.5 OUTLIER -123.28 129.66 51.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.919 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 170' ' ' VAL . . . . . 0.751 HG11 ' HG ' ' A' ' 35' ' ' LEU . 90.7 t -133.03 123.0 47.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.12 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.776 HD11 HD13 ' B' ' 136' ' ' ILE . 0.2 OUTLIER -106.66 118.46 36.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.922 179.926 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -111.23 77.73 1.06 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.851 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 14.4 mt . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.884 -179.944 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.566 ' HB3' ' O ' ' B' ' 146' ' ' ALA . . . . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 120.836 0.35 . . . . 0.0 111.134 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.497 HD21 ' HA3' ' B' ' 147' ' ' GLY . 0.1 OUTLIER -132.05 130.26 41.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.918 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -92.76 -2.46 55.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.841 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -154.41 127.28 8.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 32.4 t -51.85 107.59 0.87 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.609 0.719 . . . . 0.0 110.958 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -2.65 10.5 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.704 2.269 . . . . 0.0 112.327 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.67 -54.68 3.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.844 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.4 p -114.03 21.09 15.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.896 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 43.17 66.08 0.85 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.869 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.3 tppt? -122.51 106.69 11.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.894 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -59.29 120.72 9.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.933 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.633 ' CE2' HG13 ' A' ' 27' ' ' VAL . 37.8 m-85 -76.83 153.24 35.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.892 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.69 154.06 68.02 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.579 0.704 . . . . 0.0 111.065 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.85 167.8 23.51 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.691 2.261 . . . . 0.0 112.287 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 39.96 40.11 0.69 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.84 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.52 HD22 HG22 ' A' ' 27' ' ' VAL . 0.4 OUTLIER -81.0 -177.31 6.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.993 179.989 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.8 p -128.92 163.62 24.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.155 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.1 -36.77 51.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.927 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.773 HD13 HG21 ' B' ' 166' ' ' THR . 4.3 tp -71.65 -32.18 67.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.925 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -62.68 -48.67 78.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.81 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.633 HG13 ' CE2' ' A' ' 18' ' ' PHE . 21.4 t -75.06 -38.72 43.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.13 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -65.07 -41.5 95.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.843 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.2 m -51.7 -53.91 34.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.841 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 29.3 t-80 -70.45 -42.05 72.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.834 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.481 HD23 ' O ' ' A' ' 27' ' ' VAL . 1.3 mm? -53.24 -33.54 53.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.898 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.69 -39.07 67.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.105 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -72.28 -48.89 39.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.08 -52.16 61.84 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.553 1.158 . . . . 0.0 108.33 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.602 ' CD2' HD11 ' B' ' 144' ' ' ILE . 23.6 tp -55.73 -45.85 77.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.9 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.06 -24.51 62.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.15 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -89.64 -34.69 16.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.898 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.2 t -96.99 113.01 24.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.936 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.0 t -63.52 -27.26 69.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.149 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -61.83 134.29 56.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.852 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -113.29 58.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.899 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 42' ' ' VAL . 17.0 m -82.39 119.66 32.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.09 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.83 131.03 35.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.138 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 29.5 p90 . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.871 179.966 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.943 0.401 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -124.1 -174.61 3.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.871 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 7.9 ptt? -100.01 173.79 6.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.918 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -118.15 157.18 27.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.915 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 103' ' ' ILE . . . . . 0.447 HD11 HG11 ' B' ' 117' ' ' VAL . 14.7 pt -145.06 166.47 11.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.075 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -124.45 152.97 42.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.885 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 105' ' ' VAL . . . . . 0.963 HG21 HD11 ' B' ' 130' ' ' ILE . 62.1 t -134.74 132.27 54.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.116 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -108.69 136.46 48.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.945 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 2.3 p -99.3 164.1 12.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.167 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.9 mp -66.79 -13.88 62.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.893 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 109' ' ' THR . . . . . 0.466 HG23 ' H ' ' B' ' 111' ' ' LYS . 5.1 t -90.2 -3.6 57.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.118 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 97.29 -27.55 18.03 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.471 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 111' ' ' LYS . . . . . 0.466 ' H ' HG23 ' B' ' 109' ' ' THR . 40.1 ttpt -52.49 140.22 23.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.814 0.34 . . . . 0.0 110.883 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 83.8 m -110.07 141.71 42.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.044 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 64.4 mt -125.36 141.99 43.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.164 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 13.9 m -125.69 110.33 13.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.15 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.618 HD11 ' HD3' ' B' ' 133' ' ' LYS . 11.6 mt -129.12 168.93 15.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -103.86 146.29 28.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.872 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.531 HG11 HG12 ' B' ' 126' ' ' VAL . 34.5 m -146.74 157.83 10.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.216 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 118' ' ' GLU . . . . . 0.413 ' HB3' ' HD2' ' B' ' 119' ' ' PRO . 8.0 mt-10 -100.83 155.6 36.14 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.622 0.725 . . . . 0.0 110.851 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 119' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' B' ' 118' ' ' GLU . 52.8 Cg_endo -69.78 -8.31 23.27 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.71 2.273 . . . . 0.0 112.326 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 3.6 m -109.56 -10.43 14.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.824 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -64.46 -174.03 0.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.854 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 22.9 p -130.55 176.52 8.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.101 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 123' ' ' ILE . . . . . 0.821 HG22 ' HE2' ' B' ' 127' ' ' LYS . 39.5 mm -65.3 -50.89 70.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.159 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -57.51 -20.3 30.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.857 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.84 -51.24 23.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.944 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 126' ' ' VAL . . . . . 0.74 HG22 ' O ' ' B' ' 123' ' ' ILE . 3.5 m -56.44 -24.76 19.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.101 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 127' ' ' LYS . . . . . 0.821 ' HE2' HG22 ' B' ' 123' ' ' ILE . 40.9 mttm -79.86 -31.79 40.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.892 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.59 -51.32 69.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.171 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.558 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -72.17 -39.97 68.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.82 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 130' ' ' ILE . . . . . 0.963 HD11 HG21 ' B' ' 105' ' ' VAL . 37.3 mt -58.06 -30.25 38.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.082 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -57.31 -45.13 84.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.901 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -71.97 -11.37 60.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.915 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 133' ' ' LYS . . . . . 0.618 ' HD3' HD11 ' B' ' 115' ' ' LEU . 0.1 OUTLIER -85.46 -66.13 0.93 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.895 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -85.07 -42.23 15.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.879 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.48 42.2 1.17 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.524 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -132.07 142.28 44.52 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.611 0.72 . . . . 0.0 111.089 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 143.84 52.06 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.68 2.253 . . . . 0.0 112.362 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 138' ' ' PRO . . . . . 0.413 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.8 Cg_endo -69.75 -12.68 33.41 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.624 2.216 . . . . 0.0 112.352 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -83.19 -1.07 52.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.91 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -121.86 -37.86 2.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.969 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 141' ' ' GLN . . . . . 0.528 ' OE1' HD11 ' B' ' 169' ' ' LEU . 18.0 pt20 -84.04 145.61 28.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.959 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 26.5 mmt85 -129.6 178.42 6.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.82 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 143' ' ' LEU . . . . . 0.744 HD21 HD22 ' B' ' 167' ' ' LEU . 6.6 tp -121.51 151.68 40.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.935 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.602 HD11 ' CD2' ' A' ' 35' ' ' LEU . 30.8 mm -139.65 110.36 4.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.109 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 145' ' ' PHE . . . . . 0.771 ' CB ' HD11 ' B' ' 150' ' ' LEU . 48.1 t80 -138.22 141.95 39.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.884 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 146' ' ' ALA . . . . . 0.566 ' O ' ' HB3' ' A' ' 7' ' ' ALA . . . 63.67 24.53 13.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.098 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 147' ' ' GLY . . . . . 0.497 ' HA3' HD21 ' A' ' 8' ' ' LEU . . . 71.48 13.34 74.13 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.439 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -123.54 166.27 15.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.729 0.299 . . . . 0.0 110.933 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -92.25 123.7 35.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.921 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.771 HD11 ' CB ' ' B' ' 145' ' ' PHE . 2.2 mt -96.91 130.99 44.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.898 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -128.09 170.14 13.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.843 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -60.78 -19.22 58.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.843 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -56.47 -22.24 37.63 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.497 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 15.9 mtt-85 -128.36 166.65 18.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.896 0.379 . . . . 0.0 110.883 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 69.8 p -101.2 -179.71 4.12 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.122 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 156' ' ' LEU . . . . . 0.496 HD13 HD12 ' B' ' 161' ' ' ILE . 3.9 mm? -64.97 -47.88 76.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.017 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 34.1 t -66.03 -15.72 63.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.815 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.79 -32.67 62.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.834 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 159' ' ' TYR . . . . . 0.523 ' CG ' HD22 ' B' ' 150' ' ' LEU . 37.1 m-85 -100.7 16.11 26.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.884 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 9.4 t30 59.17 34.64 23.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.882 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 161' ' ' ILE . . . . . 0.514 HD11 HD13 ' B' ' 150' ' ' LEU . 77.9 mt -80.94 95.57 2.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.147 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -90.16 -169.5 2.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.982 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -62.55 150.09 41.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.88 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 51.18 55.83 8.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.895 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 2.3 m -89.86 132.47 35.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.873 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 166' ' ' THR . . . . . 0.773 HG21 HD13 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -92.49 94.35 9.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.087 -179.911 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.744 HD22 HD21 ' B' ' 143' ' ' LEU . 2.8 mp -112.82 142.2 45.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.949 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -97.62 169.96 9.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.841 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 169' ' ' LEU . . . . . 0.528 HD11 ' OE1' ' B' ' 141' ' ' GLN . 4.7 tp -120.9 143.04 49.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.878 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 170' ' ' VAL . . . . . 0.568 HG21 HD23 ' A' ' 35' ' ' LEU . 26.0 t -132.93 112.71 18.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.146 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.77 114.79 29.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 172' ' ' ARG . . . . . 0.565 ' HD3' HG12 ' B' ' 170' ' ' VAL . 0.5 OUTLIER -111.33 77.89 1.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.878 179.928 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.904 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.42 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.826 0.346 . . . . 0.0 111.117 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.84 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -133.09 133.38 42.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.919 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.66 2.04 49.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.917 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -154.26 125.55 7.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.818 -179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.6 t -51.98 108.02 0.97 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.679 0.752 . . . . 0.0 110.94 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -2.63 10.53 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.632 2.221 . . . . 0.0 112.346 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 15.6 mtm -93.08 -54.49 3.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.892 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.9 p -112.63 21.09 15.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.9 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 42.08 63.38 1.37 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.893 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -122.02 105.72 10.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.888 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -57.08 112.66 1.42 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.869 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.677 ' CE2' HG13 ' A' ' 27' ' ' VAL . 35.6 m-85 -66.27 153.56 42.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.861 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.91 152.74 47.75 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.564 0.697 . . . . 0.0 111.136 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 168.1 22.54 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.684 2.256 . . . . 0.0 112.325 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.57 40.69 0.65 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.817 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.502 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -82.41 -176.89 6.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.998 179.917 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.1 p -129.31 162.24 28.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.166 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -51.09 -36.23 39.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.882 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.628 HD22 HG21 ' B' ' 166' ' ' THR . 17.0 tp -71.85 -34.27 69.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.916 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -60.09 -50.56 73.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.856 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.677 HG13 ' CE2' ' A' ' 18' ' ' PHE . 60.7 t -71.09 -30.27 40.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.134 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -71.21 -43.2 67.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.823 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.407 ' HA ' ' CE1' ' B' ' 168' ' ' HIS . 49.4 m -51.67 -53.98 33.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.893 -179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -68.26 -44.89 74.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.833 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.84 HD11 HD11 ' A' ' 8' ' ' LEU . 11.5 mt -52.47 -36.57 55.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.905 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.32 -41.68 96.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.125 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -74.06 -50.0 21.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.903 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.28 -42.23 69.79 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.473 1.108 . . . . 0.0 108.24 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.454 HD23 HG11 ' B' ' 170' ' ' VAL . 23.1 tp -64.66 -49.71 69.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.954 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.72 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -60.82 -23.1 64.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.066 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -93.71 -21.45 19.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.885 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.1 t -70.47 153.69 42.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.872 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -105.82 -17.68 14.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.192 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -114.18 132.75 55.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.887 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -88.97 70.34 8.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.884 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.7 m -81.84 127.09 39.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.159 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.1 m -90.32 118.25 29.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.18 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 33.4 p90 . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.887 -179.977 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 49.7 p . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.865 0.364 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -164.95 126.31 2.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.856 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 101' ' ' MET . . . . . 0.498 ' HE2' HG23 ' B' ' 117' ' ' VAL . 10.3 ptt? -106.51 172.45 6.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.938 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -127.76 159.68 34.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.924 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 41.5 pt -142.92 162.68 17.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.107 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -126.91 119.23 26.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.85 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 105' ' ' VAL . . . . . 0.68 HG11 HD23 ' B' ' 169' ' ' LEU . 21.9 t -108.31 118.52 56.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.137 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.08 126.54 43.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.898 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 79.0 p -64.42 173.68 1.99 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.145 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.6 tp -79.95 -1.16 38.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.935 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.7 t -105.93 -12.9 15.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.142 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 120.55 -25.45 7.28 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.453 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -48.68 138.63 10.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.809 0.338 . . . . 0.0 110.916 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 90.6 m -108.77 119.63 40.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.215 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 113' ' ' ILE . . . . . 0.53 HD11 ' CG ' ' B' ' 134' ' ' GLU . 62.3 mt -109.11 142.41 21.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.111 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 19.8 m -128.0 125.74 39.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.135 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.641 HD21 ' CE ' ' B' ' 133' ' ' LYS . 13.2 mt -146.99 159.48 43.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -96.79 140.68 31.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.875 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.623 HG11 HG12 ' B' ' 126' ' ' VAL . 34.0 m -144.43 156.58 14.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.126 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -103.95 161.61 22.43 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.623 0.725 . . . . 0.0 110.903 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 -24.43 29.64 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.716 2.278 . . . . 0.0 112.353 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 56.9 p -90.28 -12.35 38.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.828 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.466 ' C ' HD23 ' B' ' 156' ' ' LEU . 71.5 m-20 -61.57 -174.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.899 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 122' ' ' THR . . . . . 0.795 HG22 HG22 ' B' ' 155' ' ' THR . 33.8 p -137.25 162.16 34.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.21 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 123' ' ' ILE . . . . . 0.455 ' O ' HG22 ' B' ' 126' ' ' VAL . 41.8 mm -55.07 -34.72 32.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.159 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -72.39 -20.49 61.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -75.93 -52.78 9.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.925 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 126' ' ' VAL . . . . . 0.623 HG12 HG11 ' B' ' 117' ' ' VAL . 3.8 m -56.8 -28.23 27.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.165 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 9.6 mmtt -78.6 -29.62 46.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.923 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.47 -51.78 68.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.046 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.621 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -70.77 -39.63 73.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.927 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 130' ' ' ILE . . . . . 0.537 HD11 HG21 ' B' ' 105' ' ' VAL . 40.9 mt -54.88 -31.3 24.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.163 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -57.44 -43.19 83.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.899 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -72.67 -12.39 61.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.868 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 133' ' ' LYS . . . . . 0.641 ' CE ' HD21 ' B' ' 115' ' ' LEU . 3.2 mptp? -88.14 -64.39 1.15 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.941 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 134' ' ' GLU . . . . . 0.53 ' CG ' HD11 ' B' ' 113' ' ' ILE . 0.3 OUTLIER -81.91 -44.83 16.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.899 179.922 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.32 39.65 1.48 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.459 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 136' ' ' ILE . . . . . 0.434 HG12 HD21 ' B' ' 171' ' ' LEU . 0.0 OUTLIER -135.29 147.75 63.45 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.613 0.72 . . . . 0.0 111.152 -179.954 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 143.03 49.75 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.667 2.245 . . . . 0.0 112.367 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.68 -9.98 27.49 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.725 2.284 . . . . 0.0 112.369 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -83.6 -0.19 49.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.863 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 140' ' ' GLN . . . . . 0.437 ' HG2' HD13 ' B' ' 173' ' ' LEU . 3.0 mt-30 -120.85 -39.29 2.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.869 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 141' ' ' GLN . . . . . 0.573 ' HB2' HD11 ' B' ' 169' ' ' LEU . 20.1 pt20 -83.67 147.94 27.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.9 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 82.8 mtt180 -138.82 172.12 13.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 143' ' ' LEU . . . . . 0.667 HD22 HD22 ' B' ' 167' ' ' LEU . 5.9 mt -114.06 153.58 29.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.887 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.604 HD13 ' O ' ' B' ' 143' ' ' LEU . 23.5 mm -137.45 103.25 2.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.179 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 145' ' ' PHE . . . . . 0.745 ' CB ' HD11 ' B' ' 150' ' ' LEU . 9.8 t80 -138.47 147.52 43.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.883 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 146' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' B' ' 145' ' ' PHE . . . 67.56 24.03 8.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.091 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 147' ' ' GLY . . . . . 0.611 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 70.64 8.39 63.24 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.458 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.69 163.75 16.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.762 0.315 . . . . 0.0 110.916 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -89.1 109.83 20.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.896 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.745 HD11 ' CB ' ' B' ' 145' ' ' PHE . 3.6 mt -77.63 129.65 35.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.864 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -138.04 172.74 12.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.906 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -60.02 -19.21 51.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.87 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -57.27 -21.38 39.85 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.458 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 11.5 mtp180 -131.43 167.75 18.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.926 0.393 . . . . 0.0 110.865 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 155' ' ' THR . . . . . 0.795 HG22 HG22 ' B' ' 122' ' ' THR . 39.8 p -101.66 179.92 4.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.174 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 156' ' ' LEU . . . . . 0.85 HD13 HD12 ' B' ' 161' ' ' ILE . 4.2 mm? -65.87 -48.09 72.71 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.9 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 43.0 t -64.83 -20.59 66.48 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.856 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.2 -31.25 68.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.808 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 159' ' ' TYR . . . . . 0.49 ' CG ' HD22 ' B' ' 150' ' ' LEU . 36.2 m-85 -100.78 13.54 34.6 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.882 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 14.5 t30 50.81 44.58 27.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.878 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 161' ' ' ILE . . . . . 0.85 HD12 HD13 ' B' ' 156' ' ' LEU . 92.3 mt -83.03 111.15 18.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.167 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -93.79 -176.2 3.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.858 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 36.0 tttt -69.43 145.37 52.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.912 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 62.91 36.94 12.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.94 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 2.3 m -72.83 139.36 46.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.875 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 166' ' ' THR . . . . . 0.628 HG21 HD22 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -97.09 107.22 19.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.153 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.667 HD22 HD22 ' B' ' 143' ' ' LEU . 1.1 mp -126.5 172.85 9.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.91 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 168' ' ' HIS . . . . . 0.407 ' CE1' ' HA ' ' A' ' 29' ' ' SER . 1.9 m-70 -121.59 169.6 10.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.863 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 169' ' ' LEU . . . . . 0.68 HD23 HG11 ' B' ' 105' ' ' VAL . 0.2 OUTLIER -116.05 127.89 55.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.897 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 170' ' ' VAL . . . . . 0.72 HG13 ' HB2' ' A' ' 36' ' ' ALA . 16.1 t -125.53 114.21 38.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.09 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.511 HD12 HD12 ' B' ' 169' ' ' LEU . 0.0 OUTLIER -101.46 119.47 38.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.91 179.919 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 -111.06 96.46 6.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.892 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 173' ' ' LEU . . . . . 0.459 HD22 ' H ' ' B' ' 173' ' ' LEU . 1.5 mm? . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.906 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 37.7 m . . . . . 0 C--O 1.233 0.189 0 CA-C-O 120.92 0.39 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -104.74 43.17 1.12 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.82 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 4.4 mtt -93.92 159.27 15.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.876 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 152.05 -128.63 2.58 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.545 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 63.88 44.9 4.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.816 0.341 . . . . 0.0 111.047 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.605 ' HB1' HG21 ' A' ' 27' ' ' VAL . . . -175.23 155.33 1.89 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.063 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.483 ' C ' HD23 ' A' ' 8' ' ' LEU . . . -84.55 -9.67 58.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.077 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 1.117 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -151.97 143.39 23.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.876 -179.95 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.1 ttp85 -102.1 -16.04 16.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.889 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -137.47 124.4 21.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.838 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.4 t -51.24 106.64 0.68 Allowed Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 121.581 0.705 . . . . 0.0 110.925 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.76 -3.92 12.98 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.611 2.207 . . . . 0.0 112.307 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -90.03 -55.1 3.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.829 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.3 p -112.13 19.53 17.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.871 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 42.93 63.06 1.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.945 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.3 ttpt -125.89 113.78 17.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.884 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -61.83 120.41 10.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.896 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.624 ' HE2' HD12 ' A' ' 8' ' ' LEU . 57.5 m-85 -71.39 153.66 42.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.841 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.91 151.01 66.53 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.555 0.693 . . . . 0.0 111.128 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 170.57 16.31 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.671 2.247 . . . . 0.0 112.4 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 40.67 37.84 0.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.901 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.435 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.6 OUTLIER -83.61 -175.98 6.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.964 -179.983 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.6 p -132.29 162.32 31.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.167 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.44 -30.65 20.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.891 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.6 HD13 HG21 ' B' ' 166' ' ' THR . 9.2 tp -72.11 -37.14 69.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.972 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.28 -59.89 4.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.837 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.684 HG11 ' HG ' ' A' ' 8' ' ' LEU . 22.7 t -54.6 -48.64 70.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.139 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 49.9 m-20 -60.25 -43.43 96.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.854 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.4 m -51.97 -47.56 64.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.848 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -75.43 -40.8 57.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 1.117 HD11 HD11 ' A' ' 8' ' ' LEU . 26.7 mt -57.78 -28.58 64.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.909 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.403 ' HA ' HG21 ' B' ' 170' ' ' VAL . . . -73.44 -51.09 18.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.092 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.736 ' HA ' HD21 ' B' ' 108' ' ' LEU . 3.1 pt20 -68.45 -32.28 72.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.921 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 t -71.82 -49.25 40.21 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.476 1.11 . . . . 0.0 108.318 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.76 HD22 HD11 ' B' ' 144' ' ' ILE . 5.9 tp -52.35 -47.13 66.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.934 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.964 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -58.88 -38.52 79.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.049 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -73.84 -34.35 64.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.91 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.8 p -63.98 162.72 13.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.895 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 68.5 p -107.51 -24.72 11.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.194 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -104.16 125.7 50.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.861 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -94.21 59.54 2.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.881 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 32.8 m -74.33 149.97 7.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.119 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 51.4 m -98.05 112.21 24.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.143 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 36.8 p90 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.899 179.996 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 96.0 p . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.929 0.395 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -122.88 125.66 45.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.864 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.633 ' HE2' HG23 ' B' ' 117' ' ' VAL . 7.0 ptt? -101.49 155.47 18.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.908 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -103.66 154.86 19.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.903 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 103' ' ' ILE . . . . . 0.604 HD11 HG13 ' B' ' 126' ' ' VAL . 42.0 pt -147.35 155.22 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.166 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -122.53 143.43 49.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.86 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 105' ' ' VAL . . . . . 0.427 HG22 ' HB2' ' B' ' 167' ' ' LEU . 42.5 t -138.06 113.82 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.112 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -99.29 147.38 25.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.92 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 107' ' ' THR . . . . . 0.45 HG22 ' CB ' ' B' ' 169' ' ' LEU . 60.8 p -100.07 179.11 4.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.132 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 108' ' ' LEU . . . . . 0.736 HD21 ' HA ' ' A' ' 33' ' ' GLN . 6.7 mp -73.2 -9.79 59.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.874 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 50.9 p -90.89 -12.59 35.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.106 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 106.56 -22.17 31.07 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.472 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 111' ' ' LYS . . . . . 0.419 ' NZ ' HD11 ' B' ' 113' ' ' ILE . 26.0 ttpp -51.8 141.87 16.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.856 0.36 . . . . 0.0 110.915 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 6.5 m -118.95 117.5 28.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.136 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 113' ' ' ILE . . . . . 0.423 HD13 HG23 ' B' ' 130' ' ' ILE . 51.2 mt -102.03 134.39 42.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.17 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 95.2 m -119.16 109.89 16.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.117 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.67 HD21 ' CE ' ' B' ' 133' ' ' LYS . 19.9 mt -133.66 170.11 16.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.895 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -110.88 148.45 32.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.794 HG11 HG22 ' B' ' 126' ' ' VAL . 19.6 m -145.57 161.52 12.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.132 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -104.56 160.9 24.48 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-O 121.709 0.766 . . . . 0.0 110.835 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 -23.21 30.89 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.635 2.223 . . . . 0.0 112.365 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 15.0 p -93.62 -10.05 35.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.843 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 -66.69 -175.82 0.43 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.884 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 122' ' ' THR . . . . . 0.789 HG22 HG22 ' B' ' 155' ' ' THR . 37.9 p -133.21 165.37 24.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.126 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 123' ' ' ILE . . . . . 0.835 HG23 HD12 ' B' ' 143' ' ' LEU . 31.6 mm -55.12 -48.45 76.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.17 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.97 -34.39 63.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.912 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -43.75 94.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.875 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 126' ' ' VAL . . . . . 0.794 HG22 HG11 ' B' ' 117' ' ' VAL . 41.0 t -56.95 -32.61 39.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.146 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 127' ' ' LYS . . . . . 0.795 ' HE3' HG22 ' B' ' 123' ' ' ILE . 26.2 mttt -78.95 -28.87 43.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.89 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.59 -51.6 68.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.082 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.626 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -72.06 -37.31 69.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.933 179.951 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 130' ' ' ILE . . . . . 0.532 ' CG1' HD12 ' B' ' 115' ' ' LEU . 66.4 mt -61.22 -28.87 44.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.124 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -58.59 -43.49 89.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.921 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -70.98 -11.5 61.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.81 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 133' ' ' LYS . . . . . 0.67 ' CE ' HD21 ' B' ' 115' ' ' LEU . 4.4 mptp? -88.99 -66.41 0.92 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.933 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -81.85 -44.32 17.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.883 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.29 35.53 2.1 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.447 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 136' ' ' ILE . . . . . 0.71 HD13 HD11 ' B' ' 171' ' ' LEU . 0.9 OUTLIER -125.0 141.54 38.7 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.652 0.739 . . . . 0.0 111.1 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 143.53 50.98 Favored 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.652 2.235 . . . . 0.0 112.41 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 138' ' ' PRO . . . . . 0.411 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.7 Cg_endo -69.76 -12.81 33.67 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.714 2.276 . . . . 0.0 112.325 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -83.13 -1.59 53.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.84 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -122.09 -38.18 2.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.961 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 141' ' ' GLN . . . . . 0.563 ' HB2' HD11 ' B' ' 169' ' ' LEU . 15.3 pt20 -83.78 148.23 27.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.96 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 20.5 mmm-85 -132.44 176.82 8.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.874 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 143' ' ' LEU . . . . . 0.835 HD12 HG23 ' B' ' 123' ' ' ILE . 17.5 mt -125.36 147.79 49.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.896 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.76 HD11 HD22 ' A' ' 35' ' ' LEU . 23.2 mm -134.94 122.2 36.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.097 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 145' ' ' PHE . . . . . 0.765 ' HB3' HD11 ' B' ' 150' ' ' LEU . 53.0 t80 -157.76 144.48 17.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.894 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 62.86 27.97 16.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.072 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 147' ' ' GLY . . . . . 0.502 ' HA3' HD21 ' A' ' 8' ' ' LEU . . . 62.88 28.75 72.38 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.514 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -136.53 151.98 50.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.797 0.332 . . . . 0.0 110.914 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -81.8 109.54 16.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.87 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.765 HD11 ' HB3' ' B' ' 145' ' ' PHE . 3.8 mt -83.0 124.41 30.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.931 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -141.38 178.14 7.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.74 -19.06 58.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.928 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -58.08 -20.15 41.19 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.471 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 10.7 mtt180 -137.72 167.74 21.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.923 0.392 . . . . 0.0 110.851 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 155' ' ' THR . . . . . 0.789 HG22 HG22 ' B' ' 122' ' ' THR . 64.3 p -103.97 179.95 4.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.182 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 156' ' ' LEU . . . . . 0.542 HD13 HD12 ' B' ' 161' ' ' ILE . 4.3 mm? -63.01 -47.78 81.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.915 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 40.5 t -62.17 -18.85 62.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.869 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -70.63 -36.57 73.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.926 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 159' ' ' TYR . . . . . 0.54 ' CG ' HD22 ' B' ' 150' ' ' LEU . 62.4 m-85 -100.61 15.73 27.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.902 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 9.3 t30 52.42 36.19 19.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.817 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 161' ' ' ILE . . . . . 0.596 HD11 HD13 ' B' ' 150' ' ' LEU . 96.8 mt -75.43 101.92 2.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.081 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -91.55 -170.91 2.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.973 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 23.3 tttm -67.83 142.72 56.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.875 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 63.28 54.06 2.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 14.4 m -92.3 135.2 34.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.848 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 166' ' ' THR . . . . . 0.6 HG21 HD13 ' A' ' 25' ' ' LEU . 0.3 OUTLIER -90.07 93.45 9.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.165 -179.945 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.44 HD23 HD12 ' B' ' 150' ' ' LEU . 5.0 mp -106.38 159.54 16.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.92 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 5.1 m80 -112.87 169.59 8.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.848 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 169' ' ' LEU . . . . . 0.563 HD11 ' HB2' ' B' ' 141' ' ' GLN . 0.3 OUTLIER -121.35 128.89 52.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.967 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 170' ' ' VAL . . . . . 0.964 HG13 ' HB2' ' A' ' 36' ' ' ALA . 45.9 t -133.05 121.06 42.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.09 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.71 HD11 HD13 ' B' ' 136' ' ' ILE . 0.3 OUTLIER -105.71 119.29 38.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.962 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 19.8 mmm-85 -111.16 77.86 1.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.855 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 6.7 mt -51.67 141.36 16.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.944 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -91.24 -60.93 1.77 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.859 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -89.62 -30.52 13.26 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.546 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.531 -179.951 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.9 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.909 0.385 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 29.3 p80 -155.71 154.73 31.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.9 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.4 ttt -79.47 114.94 18.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.867 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.88 45.49 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.473 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -127.61 54.46 1.68 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.763 0.316 . . . . 0.0 111.106 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -171.69 164.11 6.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.043 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.512 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . -90.7 -25.24 20.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.086 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.822 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -143.28 139.05 29.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.935 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.78 8.54 28.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.855 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -155.32 124.2 6.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.898 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.423 ' HA ' ' HD2' ' A' ' 12' ' ' PRO . 22.2 t -51.8 107.75 0.9 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.573 0.701 . . . . 0.0 110.853 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 11' ' ' CYS . 53.4 Cg_endo -69.77 -1.1 7.9 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.652 2.235 . . . . 0.0 112.356 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -94.63 -54.3 3.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.869 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.6 p -114.78 21.58 14.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.903 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 42.55 69.09 0.41 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.97 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -125.85 105.42 8.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.937 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -57.17 112.02 1.24 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.859 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.684 ' CE2' HG13 ' A' ' 27' ' ' VAL . 31.0 m-85 -67.47 153.29 44.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.949 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.08 151.52 34.33 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.546 0.689 . . . . 0.0 111.119 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.64 168.7 20.63 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.739 2.293 . . . . 0.0 112.386 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.4 ptt-85 39.7 40.34 0.65 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.863 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.471 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -83.79 -176.27 6.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.923 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.9 p -128.63 163.59 24.72 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.1 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.01 -31.77 42.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.87 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 13.4 tp -71.9 -32.01 66.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.942 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.24 -60.4 3.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.854 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.684 HG13 ' CE2' ' A' ' 18' ' ' PHE . 67.2 t -54.76 -37.81 41.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.119 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.464 ' OD1' HG22 ' B' ' 144' ' ' ILE . 85.6 m-20 -72.14 -38.99 69.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.862 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.6 m -51.39 -53.98 31.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.85 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -71.55 -43.66 65.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.898 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.822 HD11 HD11 ' A' ' 8' ' ' LEU . 13.3 mt -52.39 -29.63 25.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.918 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.05 -41.77 63.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.139 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -74.14 -40.48 62.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.978 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.1 t -57.83 -41.44 82.29 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.471 1.107 . . . . 0.0 108.323 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.614 HD12 HD11 ' B' ' 144' ' ' ILE . 14.3 mt -64.91 -58.82 5.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.89 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.745 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -58.03 -22.14 48.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.091 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -90.07 -24.18 21.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.862 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 t -102.07 165.0 11.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.848 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.7 t -124.92 1.25 8.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.073 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -71.1 -42.44 69.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.879 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.6 t0 61.08 53.97 3.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.914 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 16.7 t -77.4 151.87 5.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.147 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 55.4 m -123.49 118.5 27.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.112 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 40.8 p90 . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.973 179.899 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 68.7 m . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.925 0.393 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -126.16 122.91 37.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.87 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.5 ptt? -106.4 168.49 9.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.875 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -120.29 156.84 30.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.921 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 103' ' ' ILE . . . . . 0.595 HG22 ' HB3' ' B' ' 165' ' ' SER . 24.6 pt -146.39 155.21 12.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.132 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -119.44 117.47 28.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.94 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 105' ' ' VAL . . . . . 0.625 HG21 HD11 ' B' ' 130' ' ' ILE . 66.9 t -106.42 122.06 59.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.092 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 2.3 ttmm -99.26 146.91 25.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.953 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 37.5 p -93.12 164.52 13.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.159 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 6.4 tp -61.94 -17.64 57.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.913 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.6 p -90.35 -12.72 36.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.15 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 109.65 -13.08 32.71 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.427 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 43.1 tttm -51.64 138.4 23.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.844 0.354 . . . . 0.0 110.865 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 24.8 m -105.35 124.3 49.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.146 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 72.5 mt -119.38 139.9 45.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.156 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 5.4 m -123.0 128.96 50.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.095 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.709 HD13 ' HG3' ' B' ' 129' ' ' LYS . 15.4 mt -149.78 170.33 18.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.856 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -108.38 151.91 25.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.896 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.698 HG11 HG22 ' B' ' 126' ' ' VAL . 6.4 m -148.62 175.06 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.076 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -125.6 160.99 53.21 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.706 0.765 . . . . 0.0 110.831 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 -26.57 27.3 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.678 2.252 . . . . 0.0 112.365 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.6 p -89.41 -15.89 32.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.861 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -63.51 -176.23 0.15 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.868 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 122' ' ' THR . . . . . 0.558 HG22 HG22 ' B' ' 155' ' ' THR . 17.4 p -133.41 170.95 14.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.185 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 123' ' ' ILE . . . . . 0.772 HG23 HD12 ' B' ' 143' ' ' LEU . 36.5 mm -60.5 -37.37 74.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.15 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -63.21 -33.16 74.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.911 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.88 -44.27 81.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.853 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 126' ' ' VAL . . . . . 0.698 HG22 HG11 ' B' ' 117' ' ' VAL . 41.9 t -56.34 -36.95 48.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.143 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -78.58 -28.36 45.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.933 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.75 -51.67 67.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.097 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.709 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -71.89 -37.39 70.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.955 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 130' ' ' ILE . . . . . 0.625 HD11 HG21 ' B' ' 105' ' ' VAL . 62.0 mt -59.31 -28.85 40.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.076 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -58.38 -43.74 88.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.89 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -70.23 -11.93 61.24 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.866 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 133' ' ' LYS . . . . . 0.605 ' CE ' HD21 ' B' ' 115' ' ' LEU . 4.9 mptp? -89.84 -66.07 0.96 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.869 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -80.7 -45.59 16.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.869 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.2 38.62 1.63 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.466 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 136' ' ' ILE . . . . . 0.935 HD13 HD11 ' B' ' 171' ' ' LEU . 0.4 OUTLIER -130.91 143.62 50.15 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.633 0.73 . . . . 0.0 111.12 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 142.93 49.2 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.715 2.276 . . . . 0.0 112.324 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 138' ' ' PRO . . . . . 0.41 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.7 Cg_endo -69.79 -12.35 32.66 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.686 2.258 . . . . 0.0 112.295 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -83.65 -0.75 51.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.83 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -121.88 -40.23 2.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.944 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 141' ' ' GLN . . . . . 0.493 ' HB2' HD11 ' B' ' 169' ' ' LEU . 15.9 pt20 -79.65 141.74 36.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.878 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -120.35 175.66 5.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.888 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 143' ' ' LEU . . . . . 0.772 HD12 HG23 ' B' ' 123' ' ' ILE . 12.3 mt -129.22 147.58 51.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.921 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.63 HD13 ' O ' ' B' ' 143' ' ' LEU . 17.6 mm -133.4 109.04 13.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.18 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 145' ' ' PHE . . . . . 0.753 ' CB ' HD11 ' B' ' 150' ' ' LEU . 28.5 t80 -143.01 145.63 33.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.943 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 63.93 25.11 13.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.084 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 147' ' ' GLY . . . . . 0.582 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 69.58 11.25 65.08 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.497 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 1.8 mtmt -125.61 152.02 45.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.694 0.283 . . . . 0.0 110.917 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -80.3 109.7 15.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.869 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.753 HD11 ' CB ' ' B' ' 145' ' ' PHE . 3.8 mt -76.12 141.87 41.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.891 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -147.81 170.61 17.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.909 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -60.83 -18.86 58.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.839 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.19 -17.38 45.37 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.535 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 15.3 mtt180 -133.62 167.58 20.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.911 0.386 . . . . 0.0 110.874 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 155' ' ' THR . . . . . 0.558 HG22 HG22 ' B' ' 122' ' ' THR . 71.7 p -104.2 -179.91 4.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.119 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 156' ' ' LEU . . . . . 0.791 HD13 HD12 ' B' ' 161' ' ' ILE . 4.5 mm? -65.62 -47.64 74.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 76.1 p -63.0 -23.86 67.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.886 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -68.72 -31.94 71.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.852 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 159' ' ' TYR . . . . . 0.455 ' CG ' HD22 ' B' ' 150' ' ' LEU . 38.9 m-85 -100.62 15.3 28.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.914 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 5.1 t30 51.14 32.11 7.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.895 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 161' ' ' ILE . . . . . 0.791 HD12 HD13 ' B' ' 156' ' ' LEU . 83.0 mt -72.76 103.82 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.085 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 67.5 mm-40 -93.47 -169.73 2.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.94 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 22.1 tttt -66.21 144.99 56.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 63.43 50.02 3.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 165' ' ' SER . . . . . 0.595 ' HB3' HG22 ' B' ' 103' ' ' ILE . 1.5 t -87.27 122.49 31.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.896 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 1.4 m -90.68 113.81 25.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.124 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.71 HD23 ' HB2' ' B' ' 145' ' ' PHE . 0.4 OUTLIER -128.3 163.94 23.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.919 179.952 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -107.95 170.02 8.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.875 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 169' ' ' LEU . . . . . 0.552 ' CD1' HD12 ' B' ' 171' ' ' LEU . 0.6 OUTLIER -121.56 121.33 37.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.896 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 170' ' ' VAL . . . . . 0.745 HG13 ' HB2' ' A' ' 36' ' ' ALA . 17.6 t -124.11 109.93 24.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.07 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.935 HD11 HD13 ' B' ' 136' ' ' ILE . 0.1 OUTLIER -88.44 125.97 34.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.867 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 4.7 mtp180 -111.08 84.94 2.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.904 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 5.3 mt -67.46 -22.81 65.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.954 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 63.61 39.33 8.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.898 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 167.77 -99.83 0.16 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.529 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.434 -179.982 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.867 0.365 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 61.0 m170 -112.49 171.45 7.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.848 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -157.72 163.2 38.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.838 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 110.63 45.19 0.92 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.521 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -108.97 31.95 5.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.802 0.334 . . . . 0.0 111.108 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -159.09 -175.25 5.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.151 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.485 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . -88.98 -23.47 22.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.089 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.953 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -141.94 150.11 41.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.846 -179.965 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.36 -10.12 16.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.906 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -146.19 127.56 14.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.898 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.4 t -51.16 106.67 0.68 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.577 0.704 . . . . 0.0 110.9 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 -2.22 9.74 Favored 'Trans proline' 0 N--CA 1.465 -0.196 0 C-N-CA 122.745 2.297 . . . . 0.0 112.431 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 5.9 mtm -93.42 -54.86 3.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.877 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 15.2 p -114.06 22.38 13.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.901 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 41.58 70.31 0.28 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.902 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.0 tppt? -128.08 106.7 9.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.833 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -60.7 115.13 3.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.897 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.636 ' HE2' HD12 ' A' ' 8' ' ' LEU . 54.1 m-85 -70.99 153.8 42.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.847 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.59 151.97 68.61 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.596 0.712 . . . . 0.0 111.068 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.85 171.86 13.78 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.599 2.199 . . . . 0.0 112.286 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.79 37.87 0.39 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.893 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.435 ' C ' HD12 ' A' ' 22' ' ' LEU . 0.6 OUTLIER -83.99 -175.86 6.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.972 179.98 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 80.8 p -131.27 163.89 26.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.18 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -50.85 -31.84 18.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.863 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 1.014 HD12 HG21 ' B' ' 166' ' ' THR . 10.1 tt -72.18 -38.86 69.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.883 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -57.77 -46.69 84.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.861 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.568 HG11 ' HG ' ' A' ' 8' ' ' LEU . 18.7 t -72.05 -54.62 16.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.091 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -52.99 -43.01 66.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.87 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.6 m -51.38 -49.19 62.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.829 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -73.66 -45.95 49.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.802 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.953 HD11 HD11 ' A' ' 8' ' ' LEU . 62.4 mt -54.27 -25.67 24.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.922 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.41 -51.33 17.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.117 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -70.52 -31.57 68.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.928 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 t -73.28 -35.35 66.13 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.512 1.133 . . . . 0.0 108.263 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.811 HD22 HD11 ' B' ' 144' ' ' ILE . 45.7 tp -62.14 -52.07 65.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.874 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.822 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -55.78 -36.35 67.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.064 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -82.88 -16.07 48.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.864 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.3 p -67.51 136.38 54.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.867 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 51.9 m -63.11 -52.67 61.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.2 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -117.16 129.29 55.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.953 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -74.46 74.3 1.92 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.878 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.2 p -76.64 151.76 5.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.136 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.2 m -99.68 110.87 23.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.149 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 39.2 p90 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.859 -179.972 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 4.6 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.984 0.421 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -88.64 116.09 26.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.946 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 10.9 ptt? -91.73 167.84 11.89 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.868 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -121.26 136.91 54.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.968 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 103' ' ' ILE . . . . . 0.441 HD13 HG21 ' B' ' 117' ' ' VAL . 46.9 pt -124.85 155.18 33.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.126 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -116.03 115.92 26.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.838 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 105' ' ' VAL . . . . . 0.753 HG21 HD11 ' B' ' 130' ' ' ILE . 98.8 t -96.94 110.34 24.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.101 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -99.29 112.14 24.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.881 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 15.5 p -64.24 169.41 4.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.217 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 27.6 tp -73.61 -8.09 54.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.885 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 30.7 p -93.9 -12.8 28.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.179 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 111.65 -15.64 26.67 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.447 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 19.2 tptt -51.49 139.86 19.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.78 0.324 . . . . 0.0 110.981 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 12.5 m -113.19 104.07 11.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.207 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 113' ' ' ILE . . . . . 0.638 ' CD1' HG23 ' B' ' 130' ' ' ILE . 15.0 mt -100.04 141.78 16.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.151 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 25.9 m -120.34 107.98 13.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.106 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.724 HD13 ' HB2' ' B' ' 129' ' ' LYS . 38.1 mt -124.43 171.64 9.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.906 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -120.51 128.76 53.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.722 HG11 HG22 ' B' ' 126' ' ' VAL . 17.2 m -127.64 -179.61 2.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.101 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -131.01 161.18 63.19 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.614 0.721 . . . . 0.0 110.917 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 -10.73 29.29 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.699 2.266 . . . . 0.0 112.328 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 2.1 p -104.33 -22.01 13.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.871 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -59.17 -175.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.854 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 122' ' ' THR . . . . . 0.648 HG22 HG22 ' B' ' 155' ' ' THR . 22.1 p -133.31 163.04 30.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.155 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 123' ' ' ILE . . . . . 1.016 HG23 HD12 ' B' ' 143' ' ' LEU . 37.8 mm -56.18 -44.15 78.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.14 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -52.69 -33.89 49.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.841 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -66.9 -44.41 80.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.962 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 126' ' ' VAL . . . . . 0.722 HG22 HG11 ' B' ' 117' ' ' VAL . 21.5 t -60.6 -27.87 41.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.147 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 127' ' ' LYS . . . . . 0.585 ' HE3' HG22 ' B' ' 123' ' ' ILE . 93.4 mttt -78.97 -29.47 43.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.891 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -71.38 -30.79 66.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.172 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.724 ' HB2' HD13 ' B' ' 115' ' ' LEU . 0.3 OUTLIER -77.5 -49.32 15.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.858 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 130' ' ' ILE . . . . . 0.753 HD11 HG21 ' B' ' 105' ' ' VAL . 31.8 mt -53.87 -31.04 20.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.154 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -59.23 -36.83 76.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.887 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.84 -12.47 60.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.83 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 133' ' ' LYS . . . . . 0.418 ' HD3' HD21 ' B' ' 115' ' ' LEU . 2.8 mptp? -96.71 -65.86 0.94 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.924 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 134' ' ' GLU . . . . . 0.62 ' CG ' HD11 ' B' ' 113' ' ' ILE . 0.9 OUTLIER -75.96 -45.31 35.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.908 179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.21 19.97 7.74 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.453 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -110.27 144.08 29.38 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.579 0.704 . . . . 0.0 111.124 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 144.27 53.41 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.655 2.237 . . . . 0.0 112.345 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 138' ' ' PRO . . . . . 0.405 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.5 Cg_endo -69.81 -12.87 33.67 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.638 2.225 . . . . 0.0 112.283 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -82.79 -1.38 51.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.909 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -122.18 -37.72 2.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 141' ' ' GLN . . . . . 0.628 ' OE1' HD11 ' B' ' 169' ' ' LEU . 17.7 pt20 -84.95 140.94 30.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.912 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 15.1 mmt85 -122.81 179.88 4.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 143' ' ' LEU . . . . . 1.016 HD12 HG23 ' B' ' 123' ' ' ILE . 11.7 mt -127.51 146.19 50.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.905 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.811 HD11 HD22 ' A' ' 35' ' ' LEU . 24.7 mm -136.9 129.94 45.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.141 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 145' ' ' PHE . . . . . 0.809 ' HB3' HD11 ' B' ' 150' ' ' LEU . 43.0 t80 -169.24 146.16 3.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.878 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 64.79 24.29 12.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.115 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 147' ' ' GLY . . . . . 0.481 ' HA3' HD21 ' A' ' 8' ' ' LEU . . . 65.67 28.8 73.97 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.472 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -141.57 154.37 45.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.742 0.306 . . . . 0.0 110.917 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -81.95 109.51 16.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.945 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.809 HD11 ' HB3' ' B' ' 145' ' ' PHE . 3.6 mt -80.67 125.34 29.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.885 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -139.32 178.84 6.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.9 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.19 -16.55 60.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.818 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.96 -16.88 49.49 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.482 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 16.9 mtt180 -139.71 167.76 21.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.942 0.401 . . . . 0.0 110.808 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 155' ' ' THR . . . . . 0.648 HG22 HG22 ' B' ' 122' ' ' THR . 24.2 p -103.77 179.93 4.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.116 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 156' ' ' LEU . . . . . 0.67 HD13 HD12 ' B' ' 161' ' ' ILE . 4.4 mm? -63.46 -47.88 80.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.95 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 77.8 p -62.96 -17.03 61.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.948 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -71.84 -35.89 70.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.846 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 159' ' ' TYR . . . . . 0.548 ' CG ' HD22 ' B' ' 150' ' ' LEU . 68.8 m-85 -100.62 14.93 29.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.936 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 21.5 t30 51.2 41.74 28.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.938 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 161' ' ' ILE . . . . . 0.67 HD12 HD13 ' B' ' 156' ' ' LEU . 92.2 mt -80.87 104.99 10.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.131 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -93.92 -175.01 3.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.939 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 6.6 tttt -60.56 152.37 26.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.967 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 52.08 53.01 13.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.6 m -93.34 129.16 39.56 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.85 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 166' ' ' THR . . . . . 1.014 HG21 HD12 ' A' ' 25' ' ' LEU . 3.2 m -79.08 84.93 5.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.129 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.725 HD23 ' HB2' ' B' ' 145' ' ' PHE . 7.5 mt -96.98 124.96 41.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.879 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 14.2 m80 -89.57 168.43 12.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.898 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 169' ' ' LEU . . . . . 0.628 HD11 ' OE1' ' B' ' 141' ' ' GLN . 1.5 tp -126.14 143.19 51.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.878 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 170' ' ' VAL . . . . . 0.822 HG13 ' HB2' ' A' ' 36' ' ' ALA . 43.8 t -134.68 119.45 28.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.119 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.58 113.25 26.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.862 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 13.8 ttt-85 -111.31 77.85 1.07 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.811 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 2.0 mp -51.83 142.69 14.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.899 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 19.3 mmt180 -72.26 170.99 12.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.853 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -79.29 66.22 3.49 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.485 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.545 -179.976 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.0 p . . . . . 0 C--O 1.233 0.208 0 CA-C-O 120.789 0.328 . . . . 0.0 110.839 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -93.95 112.2 24.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.834 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 36.4 mtm -102.75 156.24 17.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.875 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -127.12 -102.35 1.2 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.524 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.03 111.41 3.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.8 0.333 . . . . 0.0 111.12 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -172.53 -176.03 1.46 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.091 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.541 ' C ' HD23 ' A' ' 8' ' ' LEU . . . -137.67 -44.87 0.54 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.135 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.614 HD21 ' O ' ' B' ' 147' ' ' GLY . 0.3 OUTLIER -125.29 164.58 20.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.907 -179.928 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.3 -17.42 10.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.904 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 2.0 m -152.61 127.78 9.79 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.847 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HA ' ' HD2' ' A' ' 12' ' ' PRO . 15.5 t -51.89 107.99 0.96 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.56 0.695 . . . . 0.0 110.892 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.416 ' HD2' ' HA ' ' A' ' 11' ' ' CYS . 53.4 Cg_endo -69.82 -2.87 10.94 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.605 2.203 . . . . 0.0 112.383 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtm -91.64 -54.32 3.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.931 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.8 p -113.29 20.39 16.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.928 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.08 61.13 2.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.915 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.8 ttpt -121.67 107.22 12.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -54.33 118.42 4.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.863 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.447 ' HB3' HD23 ' A' ' 22' ' ' LEU . 41.7 m-85 -70.19 152.6 44.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.891 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.71 148.8 74.25 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.535 0.683 . . . . 0.0 111.088 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 168.96 20.05 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.649 2.233 . . . . 0.0 112.368 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.3 ptt180 39.59 40.5 0.63 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.925 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.447 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -84.72 -176.5 6.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.85 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.45 161.8 28.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.122 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -50.5 -36.27 33.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.8 tt -72.13 -38.95 69.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.911 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 83.2 m-20 -52.97 -50.74 63.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.868 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.429 HG12 ' CD2' ' A' ' 31' ' ' LEU . 19.4 t -66.25 -53.58 35.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.148 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -50.99 -32.77 22.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.873 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.5 m -59.45 -54.93 40.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.859 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -71.42 -34.73 70.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.429 ' CD2' HG12 ' A' ' 27' ' ' VAL . 1.1 mp -53.09 -47.1 68.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.867 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.466 ' HA ' HG21 ' B' ' 170' ' ' VAL . . . -68.24 -33.41 74.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.09 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -73.79 -31.65 63.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.936 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -76.25 -54.63 6.51 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.489 1.118 . . . . 0.0 108.301 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.778 HD22 HG11 ' B' ' 170' ' ' VAL . 5.2 tt -51.26 -57.67 8.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.888 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.895 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -55.46 -32.2 62.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.139 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -78.19 -21.78 49.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 92.5 p -93.92 175.23 6.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.877 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.9 m -124.86 4.37 8.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.186 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -101.32 151.3 22.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.847 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -105.31 57.3 0.68 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.854 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 10.2 p -77.16 149.93 6.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.091 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.9 m -117.0 114.22 23.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.131 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.442 ' HH2' HD12 ' A' ' 35' ' ' LEU . 36.8 p90 . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.96 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 46.4 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.915 0.388 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 6.6 t-80 -133.94 126.16 29.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.851 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.6 ptt? -107.57 170.38 8.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.903 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -123.66 139.64 53.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.925 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 103' ' ' ILE . . . . . 0.45 HG12 HG22 ' B' ' 117' ' ' VAL . 29.0 pt -127.97 170.68 17.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.116 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 104' ' ' PHE . . . . . 0.6 ' CE2' HG23 ' B' ' 114' ' ' THR . 47.9 m-85 -128.91 138.59 52.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.844 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 105' ' ' VAL . . . . . 0.852 HG21 HD11 ' B' ' 130' ' ' ILE . 58.1 t -118.52 111.54 34.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.093 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.52 117.15 33.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.882 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 107' ' ' THR . . . . . 0.593 ' OG1' HG22 ' B' ' 109' ' ' THR . 11.1 p -73.15 172.72 10.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.13 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 15.2 mt -79.46 -1.61 38.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.967 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 109' ' ' THR . . . . . 0.593 HG22 ' OG1' ' B' ' 107' ' ' THR . 14.6 t -90.12 -12.49 38.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.108 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 100.34 14.99 31.34 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.549 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -97.11 145.44 26.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.871 0.367 . . . . 0.0 110.96 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 2.6 m -109.44 137.0 47.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.227 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 62.7 mt -127.53 142.28 44.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.136 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 114' ' ' THR . . . . . 0.6 HG23 ' CE2' ' B' ' 104' ' ' PHE . 1.3 m -119.76 130.86 55.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.115 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.501 HD13 ' HB2' ' B' ' 129' ' ' LYS . 13.6 mt -149.33 171.3 16.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.934 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -110.07 147.99 32.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.904 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.454 HG11 HG22 ' B' ' 126' ' ' VAL . 11.1 m -148.66 179.69 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.127 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -141.88 160.94 53.98 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.589 0.709 . . . . 0.0 110.931 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 -12.8 33.67 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.701 2.267 . . . . 0.0 112.312 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.4 p -99.12 -22.78 15.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.867 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -62.12 -172.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.892 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 122' ' ' THR . . . . . 0.536 ' CG2' HG22 ' B' ' 155' ' ' THR . 1.4 p -133.9 169.46 17.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.075 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 123' ' ' ILE . . . . . 0.74 HG23 HD12 ' B' ' 143' ' ' LEU . 40.8 mm -61.91 -49.06 85.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.152 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -52.51 -35.61 53.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.906 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -60.14 -50.31 74.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.887 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 126' ' ' VAL . . . . . 0.454 HG22 HG11 ' B' ' 117' ' ' VAL . 22.9 t -56.47 -25.09 20.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.146 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -77.42 -27.67 52.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.893 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.22 -30.33 54.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.072 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.501 ' HB2' HD13 ' B' ' 115' ' ' LEU . 0.1 OUTLIER -77.63 -29.03 51.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.83 -179.898 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 130' ' ' ILE . . . . . 0.852 HD11 HG21 ' B' ' 105' ' ' VAL . 46.6 mt -77.39 -28.33 16.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.135 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -53.82 -48.23 70.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.885 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -68.81 -11.78 60.8 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.793 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 133' ' ' LYS . . . . . 0.431 ' HD3' HD21 ' B' ' 115' ' ' LEU . 6.8 mptt -93.09 -66.07 0.95 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.928 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.16 -45.79 17.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.832 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.82 35.67 1.98 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.463 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 136' ' ' ILE . . . . . 0.756 HD13 HD11 ' B' ' 171' ' ' LEU . 0.5 OUTLIER -127.87 142.88 45.73 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.594 0.711 . . . . 0.0 111.131 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 145.64 57.42 Favored 'Trans proline' 0 C--O 1.231 0.132 0 C-N-CA 122.708 2.272 . . . . 0.0 112.302 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 138' ' ' PRO . . . . . 0.415 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 54.0 Cg_endo -69.78 -13.18 34.26 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.724 2.282 . . . . 0.0 112.324 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -82.8 -1.03 50.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.813 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -122.27 -38.12 2.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.924 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 141' ' ' GLN . . . . . 0.502 ' OE1' HD21 ' B' ' 169' ' ' LEU . 14.9 pt20 -83.72 153.88 23.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.913 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 19.0 mmt85 -138.33 179.64 6.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.9 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 143' ' ' LEU . . . . . 0.78 HD22 ' HB3' ' B' ' 167' ' ' LEU . 21.2 mt -129.99 152.43 49.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.893 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.599 HD13 ' O ' ' B' ' 143' ' ' LEU . 23.8 mm -137.24 118.31 17.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.13 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 145' ' ' PHE . . . . . 0.744 ' CB ' HD11 ' B' ' 150' ' ' LEU . 26.2 t80 -155.6 146.89 22.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.879 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 65.41 23.41 11.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.063 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 147' ' ' GLY . . . . . 0.614 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 66.01 29.36 74.84 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.466 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -143.0 154.8 44.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.799 0.333 . . . . 0.0 110.853 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -78.23 109.8 12.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.902 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.744 HD11 ' CB ' ' B' ' 145' ' ' PHE . 5.2 mt -77.25 133.75 38.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.863 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -154.67 173.16 16.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.949 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.89 -25.5 11.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.805 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -50.35 -28.36 13.93 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.51 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 13.9 mtt-85 -137.15 147.58 46.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.884 0.373 . . . . 0.0 110.92 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 155' ' ' THR . . . . . 0.536 HG22 ' CG2' ' B' ' 122' ' ' THR . 30.2 p -82.66 -179.48 7.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.123 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 156' ' ' LEU . . . . . 0.476 HD13 HD12 ' B' ' 161' ' ' ILE . 4.4 mm? -63.07 -47.52 82.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.882 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 27.9 p -59.53 -32.28 70.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.936 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -59.69 -30.86 69.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.843 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -100.61 11.74 38.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.929 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 10.4 t30 51.37 30.33 5.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.903 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 161' ' ' ILE . . . . . 0.476 HD12 HD13 ' B' ' 156' ' ' LEU . 72.1 mt -68.98 110.45 2.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.16 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 61.0 mm-40 -93.34 -169.75 2.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.969 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 32.6 tttt -70.22 155.58 40.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.926 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 51.88 52.06 15.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.868 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.2 p -87.13 152.87 21.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.825 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.5 84.19 1.93 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.123 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.78 ' HB3' HD22 ' B' ' 143' ' ' LEU . 2.5 mt -94.42 140.58 29.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.957 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -93.09 155.57 17.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.867 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 169' ' ' LEU . . . . . 0.54 ' HB3' HG22 ' B' ' 107' ' ' THR . 0.4 OUTLIER -114.64 117.49 31.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 -179.96 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 170' ' ' VAL . . . . . 0.895 HG13 ' HB2' ' A' ' 36' ' ' ALA . 90.6 t -121.98 127.65 75.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.176 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.756 HD11 HD13 ' B' ' 136' ' ' ILE . 0.1 OUTLIER -109.21 119.81 40.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.886 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -111.26 77.85 1.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.839 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 16.6 mt -52.76 171.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.917 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -123.0 51.45 1.43 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.879 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -162.21 -50.95 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.535 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.298 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.447 -179.935 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.5 p . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.927 0.394 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -131.9 26.19 4.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.878 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.6 mpt? -129.58 37.83 3.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.94 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -51.57 109.36 0.79 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.536 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.72 ' HB1' HD11 ' A' ' 22' ' ' LEU . . . -125.53 -175.31 3.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.786 0.327 . . . . 0.0 111.111 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.667 ' HB3' HG21 ' A' ' 27' ' ' VAL . . . -79.18 -168.89 1.64 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.069 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.567 ' C ' HD23 ' A' ' 8' ' ' LEU . . . -83.39 -4.65 58.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.105 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.913 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -143.18 137.62 29.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.935 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -102.24 -3.99 26.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.856 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -148.47 123.8 10.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.854 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HA ' ' HD2' ' A' ' 12' ' ' PRO . 7.9 t -51.68 107.34 0.8 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.575 0.702 . . . . 0.0 110.955 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 11' ' ' CYS . 53.7 Cg_endo -69.74 -2.9 10.94 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.684 2.256 . . . . 0.0 112.318 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 28.1 mtm -92.35 -55.07 3.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.928 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.3 p -110.59 18.2 19.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.881 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 43.79 61.25 2.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.946 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.4 ttpt -123.2 111.22 16.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.908 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -59.6 116.48 4.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.854 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.499 ' CE2' HG13 ' A' ' 27' ' ' VAL . 45.4 m-85 -68.26 153.17 44.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.871 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.4 ' O ' HD23 ' A' ' 22' ' ' LEU . . . -58.38 150.26 55.36 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.598 0.713 . . . . 0.0 111.059 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 169.21 19.4 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.665 2.243 . . . . 0.0 112.38 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.8 ptt85 39.94 39.66 0.62 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.897 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.72 HD11 ' HB1' ' A' ' 5' ' ' ALA . 0.8 OUTLIER -83.8 -176.4 6.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.922 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.3 p -129.25 162.55 27.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.206 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -51.89 -34.27 40.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.892 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.516 ' O ' HD13 ' A' ' 25' ' ' LEU . 0.3 OUTLIER -72.26 -32.91 67.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.938 179.992 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -61.3 -55.79 27.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.839 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.667 HG21 ' HB3' ' A' ' 6' ' ' ALA . 98.4 t -64.89 -32.45 58.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.137 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -71.41 -34.21 70.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.828 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 75.6 m -61.39 -53.84 51.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.869 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -69.75 -40.52 76.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.859 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.913 HD11 HD11 ' A' ' 8' ' ' LEU . 11.4 mt -52.09 -50.02 62.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.901 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.424 ' HB2' ' HB3' ' B' ' 168' ' ' HIS . . . -52.97 -50.71 63.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.086 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -62.36 -52.05 65.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.921 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -38.93 64.97 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.526 1.141 . . . . 0.0 108.334 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.685 ' HB3' HG11 ' B' ' 170' ' ' VAL . 0.4 OUTLIER -56.24 -58.34 8.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.907 179.945 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.832 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -57.75 -29.86 65.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.088 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -93.1 7.19 45.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.905 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 t -82.25 129.74 34.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.904 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 17.6 p -67.79 -24.44 65.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.105 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -139.64 128.09 22.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.855 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -81.36 83.35 6.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.872 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.8 m -99.22 173.28 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.128 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.1 m -122.3 128.17 50.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.19 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 41.2 p90 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.001 179.928 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.927 0.394 . . . . 0.0 110.868 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 6.7 p-80 -117.99 -175.35 2.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.833 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 7.4 ptt? -98.58 173.56 6.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.838 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -123.67 157.19 34.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.904 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 103' ' ' ILE . . . . . 0.53 HD13 HG21 ' B' ' 117' ' ' VAL . 31.7 pt -143.49 163.28 16.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.109 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -123.18 115.88 22.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.871 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 105' ' ' VAL . . . . . 0.887 HG21 HD11 ' B' ' 130' ' ' ILE . 44.7 t -104.87 120.04 54.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.128 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -112.24 140.43 46.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 107' ' ' THR . . . . . 0.666 HG22 HD22 ' B' ' 169' ' ' LEU . 43.9 p -94.61 -179.25 4.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.137 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 108' ' ' LEU . . . . . 0.546 HD13 ' O ' ' B' ' 169' ' ' LEU . 6.1 mp -78.1 -3.47 42.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.866 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 29.6 p -90.45 -1.74 57.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.183 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 92.69 -19.91 48.2 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.389 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 14.2 ttmm -61.16 139.32 58.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.835 0.35 . . . . 0.0 110.949 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 4.7 m -112.57 125.33 54.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.154 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 51.6 mt -110.0 142.47 22.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.151 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 29.1 m -124.15 107.56 11.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.189 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.774 HD13 ' HG3' ' B' ' 129' ' ' LYS . 11.6 mt -127.28 165.41 19.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.907 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -102.28 144.31 30.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.862 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.581 HG11 HG22 ' B' ' 126' ' ' VAL . 10.9 m -140.76 153.84 21.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.157 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -99.51 156.23 35.62 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.706 0.765 . . . . 0.0 110.907 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.82 -13.88 35.13 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.666 2.244 . . . . 0.0 112.341 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 84.3 p -105.07 -9.33 17.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.918 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.425 ' C ' HD23 ' B' ' 156' ' ' LEU . 58.0 m-20 -68.16 -174.6 0.51 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.867 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 122' ' ' THR . . . . . 0.611 HG22 HG22 ' B' ' 155' ' ' THR . 24.2 p -132.45 175.18 9.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.175 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 123' ' ' ILE . . . . . 0.832 HG22 ' HE3' ' B' ' 127' ' ' LYS . 32.7 mm -62.79 -46.84 95.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.091 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -53.94 -32.77 54.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.876 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.24 -43.13 82.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.914 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 126' ' ' VAL . . . . . 0.581 HG22 HG11 ' B' ' 117' ' ' VAL . 42.6 t -56.18 -36.27 45.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.23 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 127' ' ' LYS . . . . . 0.832 ' HE3' HG22 ' B' ' 123' ' ' ILE . 40.0 mttt -78.79 -28.65 44.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.869 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.74 -51.88 67.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.049 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.774 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -71.33 -37.95 71.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.912 179.963 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 130' ' ' ILE . . . . . 0.887 HD11 HG21 ' B' ' 105' ' ' VAL . 57.3 mt -57.92 -29.18 35.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.136 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -57.27 -47.5 81.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.859 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -69.5 -11.49 60.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.828 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 133' ' ' LYS . . . . . 0.549 ' CE ' HD21 ' B' ' 115' ' ' LEU . 12.0 mptt -88.72 -66.49 0.91 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.844 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -83.34 -45.32 13.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.858 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 111.28 41.77 1.13 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.445 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 136' ' ' ILE . . . . . 0.489 HD13 HD11 ' B' ' 171' ' ' LEU . 0.7 OUTLIER -133.82 142.15 42.56 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.61 0.719 . . . . 0.0 111.092 -179.987 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 144.32 53.4 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.732 2.288 . . . . 0.0 112.297 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.84 -12.92 33.7 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.695 2.263 . . . . 0.0 112.269 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -83.0 -0.58 49.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.885 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -120.95 -38.4 2.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.87 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 141' ' ' GLN . . . . . 0.646 ' OE1' HD11 ' B' ' 169' ' ' LEU . 18.2 pt20 -83.62 154.2 23.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.972 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 41.5 mtt85 -135.53 174.78 10.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.839 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 143' ' ' LEU . . . . . 0.793 HD23 HD12 ' B' ' 150' ' ' LEU . 6.7 tp -121.83 153.96 37.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.894 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.556 HD13 ' O ' ' B' ' 143' ' ' LEU . 30.8 mm -139.62 108.33 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.094 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 145' ' ' PHE . . . . . 0.784 ' HB2' HD23 ' B' ' 167' ' ' LEU . 23.6 t80 -144.87 146.28 31.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.859 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 64.07 23.4 13.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.099 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 147' ' ' GLY . . . . . 0.626 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 72.73 6.07 65.99 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.488 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.6 155.52 36.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.72 0.295 . . . . 0.0 110.897 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -83.68 111.78 19.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.899 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.793 HD12 HD23 ' B' ' 143' ' ' LEU . 1.6 mt -79.16 135.63 36.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.915 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -139.88 177.58 7.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.884 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -63.24 -16.98 61.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.822 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.4 -17.29 46.65 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.483 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 8.4 mtt180 -136.85 167.51 21.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.827 0.346 . . . . 0.0 110.898 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 155' ' ' THR . . . . . 0.611 HG22 HG22 ' B' ' 122' ' ' THR . 74.0 p -103.17 -179.7 4.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.073 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 156' ' ' LEU . . . . . 0.791 HD13 HD12 ' B' ' 161' ' ' ILE . 4.5 mm? -65.37 -47.86 74.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.953 179.922 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 16.1 t -65.7 -18.27 65.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.838 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.23 -31.18 63.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.847 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 159' ' ' TYR . . . . . 0.505 ' CG ' HD22 ' B' ' 150' ' ' LEU . 33.3 m-85 -100.4 13.42 34.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.932 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 17.0 t30 50.82 43.74 28.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.877 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 161' ' ' ILE . . . . . 0.791 HD12 HD13 ' B' ' 156' ' ' LEU . 92.1 mt -82.22 108.3 15.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.135 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -89.34 178.51 6.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.894 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 30.5 tttm -64.84 150.93 46.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.884 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 59.49 34.85 22.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.96 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.8 m -75.9 135.23 40.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.88 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.51 110.15 22.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.059 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.784 HD23 ' HB2' ' B' ' 145' ' ' PHE . 0.5 OUTLIER -121.75 155.54 35.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.882 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 168' ' ' HIS . . . . . 0.424 ' HB3' ' HB2' ' A' ' 32' ' ' ALA . 1.1 m80 -103.18 151.16 22.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.829 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 169' ' ' LEU . . . . . 0.666 HD22 HG22 ' B' ' 107' ' ' THR . 3.4 tp -109.61 147.57 32.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.891 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 170' ' ' VAL . . . . . 0.832 HG13 ' HB2' ' A' ' 36' ' ' ALA . 25.3 t -142.95 126.43 14.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.153 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.489 HD11 HD13 ' B' ' 136' ' ' ILE . 0.4 OUTLIER -106.22 119.8 40.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.925 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.15 77.85 1.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.829 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 12.4 mt -52.28 126.81 20.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.898 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 18.9 ttt180 -109.51 114.3 27.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.934 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 109.03 -60.77 0.32 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.47 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.46 -179.914 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.6 p . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.902 0.382 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -130.36 106.63 8.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.876 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 12.8 mtt -114.25 -75.11 0.6 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.87 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 157.58 -139.18 6.23 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.479 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -131.51 112.69 12.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.719 0.295 . . . . 0.0 111.112 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.592 ' HB1' HG21 ' A' ' 27' ' ' VAL . . . -175.1 115.43 0.15 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.098 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.451 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . -60.53 -21.5 62.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.063 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.935 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -139.74 157.37 45.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.876 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -123.46 10.22 9.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.839 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.3 m -154.49 119.26 4.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.854 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 35.1 t -51.31 107.25 0.78 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.569 0.699 . . . . 0.0 110.879 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.408 ' HD2' HD21 ' A' ' 31' ' ' LEU . 53.0 Cg_endo -69.77 -2.51 10.31 Favored 'Trans proline' 0 N--CA 1.465 -0.188 0 C-N-CA 122.693 2.262 . . . . 0.0 112.348 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.4 ttm -91.45 -53.76 4.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.875 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.3 p -116.08 21.55 13.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.898 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.04 67.54 0.62 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.939 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 tppt? -124.41 107.71 11.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.877 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -59.23 112.1 1.59 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.839 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.68 ' CE2' HG13 ' A' ' 27' ' ' VAL . 41.5 m-85 -64.59 152.81 41.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.84 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -71.66 148.23 92.56 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.521 0.677 . . . . 0.0 111.114 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 167.97 22.95 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.626 2.217 . . . . 0.0 112.335 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 60.46 17.74 7.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.459 ' C ' HD12 ' A' ' 22' ' ' LEU . 0.6 OUTLIER -76.8 -174.9 3.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.949 -179.986 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.2 p -139.8 169.9 16.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.181 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -52.2 -34.36 45.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.895 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 13.8 tp -72.19 -31.9 66.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.899 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.57 -60.54 3.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.872 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.68 HG13 ' CE2' ' A' ' 18' ' ' PHE . 21.0 t -57.15 -36.51 51.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.153 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -71.65 -41.01 69.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.876 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.5 m -51.54 -53.79 34.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.897 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -68.52 -49.98 55.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.893 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.935 HD11 HD11 ' A' ' 8' ' ' LEU . 12.6 mt -53.12 -25.54 13.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.874 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.08 -49.85 33.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.124 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -30.98 63.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.937 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.6 t -71.37 -23.08 61.83 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.454 1.096 . . . . 0.0 108.325 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 45.3 tp -84.93 -50.06 7.82 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.907 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.997 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -66.94 -15.9 63.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.071 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.32 -25.38 14.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.903 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 56.7 p -72.54 168.2 19.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.862 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.43 4.13 13.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.192 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -117.72 159.17 23.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.885 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -124.77 65.17 1.11 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.906 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 20.7 m -89.53 133.97 30.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.188 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.0 m -99.7 119.74 38.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.159 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.472 ' HZ2' HD13 ' A' ' 31' ' ' LEU . 36.8 p90 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.909 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.899 0.38 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -116.33 114.31 24.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.893 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.7 ptt? -96.07 164.73 12.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.899 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -115.29 158.95 21.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.968 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 22.8 pt -149.76 155.25 8.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.122 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -121.95 141.25 51.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.934 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 105' ' ' VAL . . . . . 0.812 HG11 HD23 ' B' ' 169' ' ' LEU . 93.1 t -131.58 113.58 23.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.161 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -99.26 132.91 44.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 107' ' ' THR . . . . . 0.41 HG22 ' HB3' ' B' ' 169' ' ' LEU . 68.0 p -87.44 175.75 7.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.099 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 13.6 mt -73.74 -10.3 59.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.902 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 24.4 p -90.38 -12.72 36.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.066 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 107.59 -14.72 38.65 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.464 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 2.9 ttmp? -51.8 148.29 5.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.966 0.412 . . . . 0.0 110.893 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 23.1 m -125.69 104.07 8.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.177 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 57.0 mt -96.93 141.99 14.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.146 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 90.6 m -130.05 108.83 10.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.21 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.681 HD13 ' HG3' ' B' ' 129' ' ' LYS . 13.8 mt -130.18 170.48 14.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.83 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -114.43 148.14 38.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.845 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.776 HG11 HG22 ' B' ' 126' ' ' VAL . 11.0 m -140.12 178.75 3.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.174 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -122.05 160.57 46.78 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.58 0.705 . . . . 0.0 110.886 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 -20.68 34.18 Favored 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.686 2.258 . . . . 0.0 112.299 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 57.4 m -96.83 -6.92 34.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.858 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -73.0 -175.78 1.88 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.918 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 122' ' ' THR . . . . . 0.493 ' CG2' HG22 ' B' ' 155' ' ' THR . 5.2 p -135.07 164.34 27.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.189 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 123' ' ' ILE . . . . . 0.823 HG22 ' HE2' ' B' ' 127' ' ' LYS . 38.2 mm -54.27 -38.8 40.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.149 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -60.77 -35.78 77.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.907 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.03 -41.88 94.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.857 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 126' ' ' VAL . . . . . 0.776 HG22 HG11 ' B' ' 117' ' ' VAL . 23.9 t -56.74 -38.4 58.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.072 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 127' ' ' LYS . . . . . 0.823 ' HE2' HG22 ' B' ' 123' ' ' ILE . 25.0 mttm -78.21 -28.94 48.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.76 -51.67 68.0 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.15 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.681 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -72.19 -39.23 68.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.935 179.919 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 130' ' ' ILE . . . . . 0.446 ' CG1' HD12 ' B' ' 115' ' ' LEU . 55.9 mt -57.02 -29.58 31.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.146 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -56.39 -46.13 80.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.925 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -69.72 -11.69 61.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.81 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 133' ' ' LYS . . . . . 0.559 ' HD3' HD11 ' B' ' 115' ' ' LEU . 10.0 mptt -89.61 -66.26 0.94 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.898 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 134' ' ' GLU . . . . . 0.429 ' OE1' HD12 ' B' ' 136' ' ' ILE . 1.1 tm-20 -81.81 -45.49 15.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.898 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.69 37.34 1.74 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.533 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 136' ' ' ILE . . . . . 0.627 HD13 HD11 ' B' ' 171' ' ' LEU . 0.6 OUTLIER -129.37 142.22 44.49 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.631 0.729 . . . . 0.0 111.184 179.982 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 144.36 53.65 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.61 2.206 . . . . 0.0 112.35 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 138' ' ' PRO . . . . . 0.406 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.6 Cg_endo -69.77 -14.64 36.33 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.724 2.283 . . . . 0.0 112.312 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -81.57 -0.71 43.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.857 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -121.49 -37.59 2.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.961 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 141' ' ' GLN . . . . . 0.467 ' HB2' HD11 ' B' ' 169' ' ' LEU . 18.7 pt20 -85.43 155.02 21.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.913 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 45.5 mtt180 -139.06 -178.67 5.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.902 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 143' ' ' LEU . . . . . 0.804 HD12 HG23 ' B' ' 123' ' ' ILE . 13.2 mt -130.0 153.98 47.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.539 HD13 ' O ' ' B' ' 143' ' ' LEU . 22.0 mm -136.14 119.31 22.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.066 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 145' ' ' PHE . . . . . 0.819 ' HB3' HD11 ' B' ' 150' ' ' LEU . 5.1 t80 -153.48 146.38 24.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.874 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 65.45 28.81 11.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.132 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 147' ' ' GLY . . . . . 0.691 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 69.62 8.88 60.91 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.505 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.36 159.98 37.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.665 0.269 . . . . 0.0 110.926 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.87 128.44 34.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.87 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.819 HD11 ' HB3' ' B' ' 145' ' ' PHE . 5.1 mt -96.93 130.06 44.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.926 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -131.12 178.56 6.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.88 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.74 -16.86 59.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.918 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -55.28 -22.73 31.09 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.464 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 6.0 mtp85 -137.22 167.9 20.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.906 0.384 . . . . 0.0 110.821 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 155' ' ' THR . . . . . 0.493 HG22 ' CG2' ' B' ' 122' ' ' THR . 64.1 p -99.19 -179.6 4.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.157 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 156' ' ' LEU . . . . . 0.621 HD12 HG21 ' B' ' 161' ' ' ILE . 3.7 mm? -65.06 -44.61 88.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.907 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 11.0 p -67.46 -18.31 65.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.894 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -76.84 -30.92 56.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.915 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 159' ' ' TYR . . . . . 0.591 ' CG ' HD22 ' B' ' 150' ' ' LEU . 27.7 m-85 -100.74 15.97 26.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.937 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 13.2 t30 57.88 34.21 24.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.905 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 161' ' ' ILE . . . . . 0.621 HG21 HD12 ' B' ' 156' ' ' LEU . 28.1 mm -68.93 109.08 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.183 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 81.1 mm-40 -101.24 173.47 6.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.955 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -61.02 140.38 57.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.868 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 58.63 48.93 11.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.879 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 3.3 m -82.96 137.92 34.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.872 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.67 96.63 8.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.148 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.589 ' HB3' HD22 ' B' ' 143' ' ' LEU . 6.0 mt -107.63 172.12 7.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.878 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 168' ' ' HIS . . . . . 0.492 ' O ' HD23 ' B' ' 143' ' ' LEU . 35.5 m-70 -132.39 170.06 15.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.846 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 169' ' ' LEU . . . . . 0.812 HD23 HG11 ' B' ' 105' ' ' VAL . 0.2 OUTLIER -121.57 119.11 30.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.952 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 170' ' ' VAL . . . . . 0.997 HG13 ' HB2' ' A' ' 36' ' ' ALA . 23.6 t -125.36 114.81 41.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.119 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.627 HD11 HD13 ' B' ' 136' ' ' ILE . 0.2 OUTLIER -99.76 119.36 38.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.94 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -111.13 77.96 1.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.861 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 9.0 mt -51.58 140.37 18.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.848 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 5.4 ppt_? -98.9 -26.28 14.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.901 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -93.39 24.01 27.39 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.463 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.351 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.422 -179.959 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.892 0.377 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 15.9 p80 -120.44 44.76 2.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.851 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 36.1 mtt -78.73 77.0 5.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.859 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.36 94.16 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.532 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -97.79 75.06 2.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.758 0.313 . . . . 0.0 111.091 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.544 ' CB ' HG21 ' A' ' 27' ' ' VAL . . . -172.58 158.81 4.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.138 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.438 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . -51.84 -34.48 40.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.082 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.958 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -134.29 129.83 36.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.893 -179.923 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.45 4.45 52.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.9 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.5 m -154.53 126.63 7.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.934 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HA ' ' HD2' ' A' ' 12' ' ' PRO . 11.2 t -52.14 108.23 1.03 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.693 0.759 . . . . 0.0 110.903 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.43 ' HD2' ' HA ' ' A' ' 11' ' ' CYS . 53.0 Cg_endo -69.86 -0.73 7.42 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.623 2.215 . . . . 0.0 112.298 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -96.26 -54.04 3.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.868 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.9 p -114.39 22.23 13.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.916 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.5 tp60 41.46 68.18 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.866 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.1 tppt? -125.08 103.88 8.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.911 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -56.31 107.99 0.43 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.881 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.687 ' CE2' HG13 ' A' ' 27' ' ' VAL . 36.2 m-85 -63.22 153.08 35.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.823 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.48 150.45 34.25 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.59 0.71 . . . . 0.0 111.067 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 168.6 21.22 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.642 2.228 . . . . 0.0 112.352 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 39.73 40.47 0.67 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.86 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.422 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -84.16 -176.49 6.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.967 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.9 p -129.46 164.4 23.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.107 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -52.35 -31.44 33.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.865 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.8 tp -71.92 -33.83 68.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.858 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.88 -59.51 4.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.871 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.687 HG13 ' CE2' ' A' ' 18' ' ' PHE . 21.7 t -57.59 -37.09 56.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.229 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -71.76 -36.29 70.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.878 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.6 m -54.92 -54.02 48.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.872 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -72.54 -43.12 63.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.87 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.958 HD11 HD11 ' A' ' 8' ' ' LEU . 13.5 mt -51.91 -31.81 30.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.883 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.34 -38.81 65.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.11 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -74.27 -45.58 46.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -53.1 -52.19 59.43 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.512 1.132 . . . . 0.0 108.271 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.657 HD12 HD11 ' B' ' 144' ' ' ILE . 17.0 mt -52.52 -56.21 16.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.911 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.817 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -57.94 -22.19 47.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.074 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -102.98 8.9 38.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.871 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.6 m -116.7 167.07 11.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.879 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.8 m -124.35 -33.54 3.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.142 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -51.16 -56.1 14.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.843 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 t0 63.72 54.49 1.82 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.899 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 29.4 m -81.64 165.11 2.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.128 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 6.1 m -115.01 117.07 29.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.095 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 33.5 p90 . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.972 179.93 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.864 0.364 . . . . 0.0 110.863 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -167.99 122.25 0.95 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.91 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.486 ' HE2' HG23 ' B' ' 117' ' ' VAL . 5.6 ptt? -100.69 170.73 8.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.903 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -119.84 141.72 49.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.934 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 103' ' ' ILE . . . . . 0.651 HD13 HG21 ' B' ' 117' ' ' VAL . 42.1 pt -134.43 164.86 33.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.094 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -122.43 149.11 44.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.876 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 105' ' ' VAL . . . . . 0.583 HG21 HD11 ' B' ' 130' ' ' ILE . 61.6 t -136.84 117.6 17.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.137 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.22 155.49 17.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.83 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 107' ' ' THR . . . . . 0.553 HG22 HD22 ' B' ' 169' ' ' LEU . 61.8 p -112.86 170.06 8.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.143 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 108' ' ' LEU . . . . . 0.408 HD11 ' CB ' ' A' ' 36' ' ' ALA . 63.7 mt -64.83 -15.8 62.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.937 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 24.0 p -90.43 -12.55 37.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.091 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 104.22 -8.98 49.57 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.508 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 8.6 ttmm -51.75 142.39 14.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.912 0.387 . . . . 0.0 110.881 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 27.8 m -112.34 106.42 14.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.157 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 71.8 mt -100.68 141.79 16.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.207 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 31.6 m -129.25 122.62 30.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.187 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.613 HD21 ' HE2' ' B' ' 133' ' ' LYS . 12.8 mt -144.49 170.57 15.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.883 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -109.77 151.31 27.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.917 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.651 HG21 HD13 ' B' ' 103' ' ' ILE . 4.1 m -146.7 174.71 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.098 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -122.15 161.32 43.45 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.621 0.724 . . . . 0.0 110.873 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 -9.21 25.52 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.712 2.275 . . . . 0.0 112.315 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 13.0 m -103.5 -19.35 14.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.861 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -59.34 -174.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.876 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 122' ' ' THR . . . . . 0.907 HG22 HG22 ' B' ' 155' ' ' THR . 59.2 p -142.13 172.87 12.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.105 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 123' ' ' ILE . . . . . 1.058 HG23 HD12 ' B' ' 143' ' ' LEU . 28.1 mm -58.35 -35.52 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.167 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -74.7 -25.02 58.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.876 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -74.45 -50.37 18.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.868 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 126' ' ' VAL . . . . . 0.411 HG23 HD11 ' B' ' 103' ' ' ILE . 2.4 p -56.59 -33.39 39.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.096 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -77.69 -28.46 51.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.945 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.49 -52.57 64.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.098 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.41 ' HD3' ' HA ' ' B' ' 126' ' ' VAL . 0.0 OUTLIER -70.98 -30.69 67.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 179.967 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 130' ' ' ILE . . . . . 0.583 HD11 HG21 ' B' ' 105' ' ' VAL . 47.5 mt -63.63 -29.37 47.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.082 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -58.15 -42.69 86.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.88 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -69.73 -11.44 60.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.872 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 133' ' ' LYS . . . . . 0.613 ' HE2' HD21 ' B' ' 115' ' ' LEU . 2.1 mptp? -90.92 -65.7 0.99 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.872 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -82.12 -45.48 15.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.911 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.3 42.35 1.18 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.472 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 136' ' ' ILE . . . . . 0.711 HD13 HD11 ' B' ' 171' ' ' LEU . 0.5 OUTLIER -136.78 143.1 41.3 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.688 0.756 . . . . 0.0 111.101 -179.976 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 144.79 55.33 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.707 2.272 . . . . 0.0 112.342 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 138' ' ' PRO . . . . . 0.405 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.8 Cg_endo -69.78 -12.74 33.47 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.693 2.262 . . . . 0.0 112.365 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -83.53 -0.3 49.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.869 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -119.6 -39.42 2.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.966 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 141' ' ' GLN . . . . . 0.405 ' HG2' ' HA ' ' B' ' 138' ' ' PRO . 19.5 pt20 -80.29 147.74 31.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.927 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -121.74 -178.46 3.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.89 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 143' ' ' LEU . . . . . 1.058 HD12 HG23 ' B' ' 123' ' ' ILE . 12.1 mt -136.39 147.98 47.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.918 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.677 HD13 ' O ' ' B' ' 143' ' ' LEU . 17.2 mm -134.0 125.71 49.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.126 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 145' ' ' PHE . . . . . 0.738 ' HB2' HD11 ' B' ' 150' ' ' LEU . 4.9 t80 -155.81 143.3 19.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.887 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 59.1 26.37 15.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.128 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 147' ' ' GLY . . . . . 0.643 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 71.89 9.54 70.9 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.45 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.87 151.37 40.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.785 0.326 . . . . 0.0 110.877 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -82.92 109.96 17.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.959 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.738 HD11 ' HB2' ' B' ' 145' ' ' PHE . 4.5 mt -75.86 132.69 40.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.944 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -128.25 159.44 35.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.906 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -53.29 -26.7 19.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.886 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -52.05 -25.92 18.49 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.502 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -118.37 167.64 11.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.896 0.379 . . . . 0.0 110.925 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 155' ' ' THR . . . . . 0.907 HG22 HG22 ' B' ' 122' ' ' THR . 65.0 p -110.57 -179.4 3.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.13 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 156' ' ' LEU . . . . . 0.591 HD13 HD12 ' B' ' 161' ' ' ILE . 3.7 mm? -64.28 -41.1 97.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.942 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 38.2 t -67.25 -19.73 65.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.859 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -75.42 -35.88 60.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 159' ' ' TYR . . . . . 0.415 ' CG ' HD22 ' B' ' 150' ' ' LEU . 40.5 m-85 -100.47 8.44 43.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.958 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 10.2 t30 51.23 45.02 28.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.916 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 161' ' ' ILE . . . . . 0.591 HD12 HD13 ' B' ' 156' ' ' LEU . 87.9 mt -78.98 105.31 8.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.098 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 64.7 mm-40 -89.62 -169.59 2.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.957 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 29.4 tttt -70.26 155.9 40.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.92 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 51.98 52.23 14.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.894 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.4 p -91.29 132.63 36.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.92 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 5.5 m -87.04 84.49 7.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.118 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.616 ' HB3' HD22 ' B' ' 143' ' ' LEU . 6.1 mt -97.92 134.71 40.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 56.5 m-70 -99.14 143.26 29.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.862 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 169' ' ' LEU . . . . . 0.9 HD21 HD12 ' B' ' 171' ' ' LEU . 2.2 tt -103.61 140.85 37.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.89 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 170' ' ' VAL . . . . . 0.817 HG13 ' HB2' ' A' ' 36' ' ' ALA . 11.4 t -138.57 111.17 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.08 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.9 HD12 HD21 ' B' ' 169' ' ' LEU . 0.1 OUTLIER -86.95 119.6 27.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.919 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 12.6 tpp85 -111.64 77.37 1.04 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.831 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 8.0 mp -51.76 167.83 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.861 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.77 118.05 34.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.886 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 110.77 -52.66 0.62 Allowed Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.472 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.489 -179.882 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 66.1 m . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.941 0.401 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -87.7 -31.73 19.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.838 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 5.7 ptm -134.99 153.06 52.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.869 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 129.17 -121.99 3.72 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.466 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 58.98 43.32 17.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.83 0.348 . . . . 0.0 111.066 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.468 ' HB1' HG21 ' A' ' 27' ' ' VAL . . . -172.57 154.88 3.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.073 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.423 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . -69.57 -31.95 70.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.121 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.64 HD12 ' HE2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -138.17 145.81 41.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.93 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.56 -1.54 21.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.842 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -154.29 123.25 6.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.886 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.9 t -51.24 106.58 0.67 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.594 0.711 . . . . 0.0 110.873 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.7 -3.8 12.71 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.703 2.269 . . . . 0.0 112.375 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.0 mtt -89.03 -54.82 3.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.86 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.0 p -113.91 19.49 16.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.955 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 44.44 67.19 0.72 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.853 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 tppt? -124.02 111.71 16.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.816 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -64.76 120.75 13.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.896 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.64 ' HE2' HD12 ' A' ' 8' ' ' LEU . 39.8 m-85 -75.77 153.28 37.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.868 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.39 152.19 45.12 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.564 0.697 . . . . 0.0 111.074 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 170.3 16.82 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.678 2.252 . . . . 0.0 112.335 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.6 39.04 0.46 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.901 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.543 HD22 HG22 ' A' ' 27' ' ' VAL . 0.5 OUTLIER -83.47 -179.12 7.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.864 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -125.76 163.95 21.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.078 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -51.29 -37.15 45.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.909 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.455 ' O ' HD13 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -71.59 -40.06 70.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.922 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -53.6 -46.4 70.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.885 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.624 HG13 ' CE2' ' A' ' 18' ' ' PHE . 11.8 t -71.28 -55.84 12.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.113 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.512 ' HA ' HD22 ' A' ' 31' ' ' LEU . 37.1 m-20 -51.43 -32.67 27.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.817 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.3 m -54.53 -54.63 38.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.84 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -70.15 -35.25 73.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.925 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.634 HD21 HD11 ' A' ' 8' ' ' LEU . 0.4 OUTLIER -53.89 -44.47 70.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.907 179.974 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.51 -33.72 76.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.048 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -73.82 -53.1 11.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.935 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -53.49 -56.96 12.6 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.5 1.125 . . . . 0.0 108.327 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.751 ' HG ' HG11 ' B' ' 170' ' ' VAL . 24.8 tp -52.34 -48.79 65.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.998 -1.001 . . . . 0.0 110.909 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.652 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -62.09 -22.04 65.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.115 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -99.39 -2.52 36.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.896 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -112.05 157.13 21.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.856 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.0 p -107.83 4.22 25.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.159 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -110.44 103.94 12.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.91 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -80.0 62.88 4.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.801 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.5 p -77.93 145.28 10.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.106 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 33.0 m -99.74 111.0 23.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.143 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 38.3 p90 . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.895 -179.997 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 5.3 m . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.907 0.384 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -134.66 -81.09 0.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.906 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -172.13 155.83 3.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.847 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -109.18 147.41 32.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.989 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' ILE . . . . . 0.49 HD13 HG21 ' B' ' 117' ' ' VAL . 44.4 pt -139.76 155.24 24.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.099 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -120.24 141.4 49.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.891 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 105' ' ' VAL . . . . . 0.578 HG21 HD11 ' B' ' 130' ' ' ILE . 39.0 t -129.0 125.64 63.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.067 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.23 154.23 18.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.917 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 39.5 p -111.54 175.24 5.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.093 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 108' ' ' LEU . . . . . 0.524 HD11 ' CB ' ' A' ' 36' ' ' ALA . 12.8 mt -71.55 -12.94 61.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.878 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 49.1 p -90.43 -12.62 36.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.156 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 102.7 -15.12 56.03 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.501 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 19.0 ttmt -51.74 155.22 1.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.885 0.374 . . . . 0.0 110.848 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 54.9 m -118.83 107.48 13.67 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.095 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 63.7 mt -97.11 141.89 14.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.142 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 11.6 m -129.2 131.2 47.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.161 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.818 HD13 ' HG3' ' B' ' 129' ' ' LYS . 17.8 mt -150.13 170.43 18.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.915 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -109.78 148.58 31.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.897 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.574 HG11 HG22 ' B' ' 126' ' ' VAL . 23.8 m -148.65 169.22 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.128 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -113.09 157.65 40.21 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.711 0.767 . . . . 0.0 110.825 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -10.39 28.38 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.667 2.245 . . . . 0.0 112.372 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 14.8 m -107.33 -13.05 15.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.834 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -63.86 -175.21 0.13 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.875 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 122' ' ' THR . . . . . 0.475 HG22 HG22 ' B' ' 155' ' ' THR . 21.6 p -132.1 165.99 22.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.121 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 123' ' ' ILE . . . . . 0.875 HG23 HD12 ' B' ' 143' ' ' LEU . 37.9 mm -57.51 -41.06 78.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.113 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -57.56 -33.23 67.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.872 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.52 -42.44 74.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.864 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 126' ' ' VAL . . . . . 0.574 HG22 HG11 ' B' ' 117' ' ' VAL . 36.1 t -56.67 -35.52 45.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.147 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 127' ' ' LYS . . . . . 0.793 ' HE2' HG22 ' B' ' 123' ' ' ILE . 34.3 mttm -78.56 -28.7 45.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.909 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.56 -51.88 66.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.064 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.818 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -71.57 -39.88 70.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.942 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 130' ' ' ILE . . . . . 0.578 HD11 HG21 ' B' ' 105' ' ' VAL . 51.6 mt -53.68 -29.92 18.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.114 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -60.78 -41.49 95.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.925 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -68.81 -11.49 60.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.819 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 133' ' ' LYS . . . . . 0.525 ' HD3' HD21 ' B' ' 115' ' ' LEU . 0.1 OUTLIER -93.86 -66.12 0.94 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.905 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -80.5 -46.44 15.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.863 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.27 35.03 2.19 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.495 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 136' ' ' ILE . . . . . 0.776 HD13 HD11 ' B' ' 171' ' ' LEU . 0.7 OUTLIER -124.97 142.07 40.11 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.579 0.704 . . . . 0.0 111.107 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.86 144.59 53.98 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.619 2.213 . . . . 0.0 112.338 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 138' ' ' PRO . . . . . 0.401 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 54.1 Cg_endo -69.77 -13.06 34.11 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.705 2.27 . . . . 0.0 112.36 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -82.62 -1.45 51.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.896 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -122.25 -38.14 2.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.9 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 141' ' ' GLN . . . . . 0.564 ' OE1' HD21 ' B' ' 169' ' ' LEU . 12.5 pt20 -83.38 153.66 24.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.908 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 29.0 mtt-85 -137.03 179.56 6.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.852 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 143' ' ' LEU . . . . . 0.875 HD12 HG23 ' B' ' 123' ' ' ILE . 13.0 mt -128.04 152.4 47.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.855 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.555 HD13 ' O ' ' B' ' 143' ' ' LEU . 23.7 mm -138.61 111.14 6.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.095 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 145' ' ' PHE . . . . . 0.726 ' HB3' HD11 ' B' ' 150' ' ' LEU . 4.2 t80 -146.35 145.43 30.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.854 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 63.93 24.37 13.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.083 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 68.68 28.35 73.2 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.467 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -143.99 154.3 43.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.791 0.329 . . . . 0.0 110.905 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -84.46 109.7 18.1 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.857 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.726 HD11 ' HB3' ' B' ' 145' ' ' PHE . 3.8 mt -81.31 131.39 35.29 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.919 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -137.99 -179.66 5.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.95 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.02 -16.57 60.28 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.829 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -58.87 -19.01 42.14 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.512 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 14.1 mtp85 -140.31 167.79 21.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.859 0.361 . . . . 0.0 110.882 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 155' ' ' THR . . . . . 0.475 HG22 HG22 ' B' ' 122' ' ' THR . 41.4 p -101.2 -179.86 4.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.211 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 156' ' ' LEU . . . . . 0.64 HD12 HG21 ' B' ' 161' ' ' ILE . 3.7 mm? -64.06 -47.61 79.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.944 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 8.5 p -65.48 -16.29 63.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.842 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.44 -32.54 58.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.824 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 159' ' ' TYR . . . . . 0.714 ' CG ' HD22 ' B' ' 150' ' ' LEU . 33.0 m-85 -100.7 16.05 26.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.895 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 8.2 t30 59.08 34.97 23.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.898 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 161' ' ' ILE . . . . . 0.64 HG21 HD12 ' B' ' 156' ' ' LEU . 28.9 mm -68.61 104.22 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.151 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -96.42 175.63 6.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.895 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 38.1 tttt -60.5 141.82 56.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.883 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 63.99 35.95 10.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.858 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 165' ' ' SER . . . . . 0.418 ' HB3' HD11 ' B' ' 167' ' ' LEU . 1.5 m -67.68 128.95 38.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.814 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 166' ' ' THR . . . . . 0.404 ' CG2' HD21 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -93.26 96.31 9.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.145 179.986 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.634 ' HB3' HD22 ' B' ' 143' ' ' LEU . 4.9 mp -106.76 166.76 10.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.949 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 168' ' ' HIS . . . . . 0.461 ' O ' HD23 ' B' ' 143' ' ' LEU . 78.2 m80 -115.59 169.9 8.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.933 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 169' ' ' LEU . . . . . 0.598 HD13 ' N ' ' B' ' 170' ' ' VAL . 0.5 OUTLIER -123.28 129.66 51.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.919 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 170' ' ' VAL . . . . . 0.751 HG11 ' HG ' ' A' ' 35' ' ' LEU . 90.7 t -133.03 123.0 47.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.12 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.776 HD11 HD13 ' B' ' 136' ' ' ILE . 0.2 OUTLIER -106.66 118.46 36.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.922 179.926 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -111.23 77.73 1.06 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.851 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 14.4 mt -51.38 128.43 22.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.884 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -68.39 -49.93 56.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.887 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 130.05 68.42 0.11 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.511 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.376 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.505 -179.88 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 21.9 m . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.89 0.376 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 11.6 t60 -156.84 130.43 8.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.826 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -133.28 172.97 11.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.827 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 129.01 -16.3 5.79 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.505 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -94.84 37.67 1.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.824 0.345 . . . . 0.0 111.09 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.442 ' HB1' HG21 ' A' ' 27' ' ' VAL . . . -175.93 142.69 0.53 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.071 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.566 ' HB3' ' O ' ' B' ' 146' ' ' ALA . . . -87.95 -21.24 25.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.134 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.497 HD21 ' HA3' ' B' ' 147' ' ' GLY . 0.1 OUTLIER -132.05 130.26 41.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.918 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -92.76 -2.46 55.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.841 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -154.41 127.28 8.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 32.4 t -51.85 107.59 0.87 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.609 0.719 . . . . 0.0 110.958 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -2.65 10.5 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.704 2.269 . . . . 0.0 112.327 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.67 -54.68 3.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.844 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.4 p -114.03 21.09 15.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.896 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 43.17 66.08 0.85 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.869 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.3 tppt? -122.51 106.69 11.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.894 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -59.29 120.72 9.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.933 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.633 ' CE2' HG13 ' A' ' 27' ' ' VAL . 37.8 m-85 -76.83 153.24 35.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.892 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.69 154.06 68.02 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.579 0.704 . . . . 0.0 111.065 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.85 167.8 23.51 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.691 2.261 . . . . 0.0 112.287 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 39.96 40.11 0.69 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.84 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.52 HD22 HG22 ' A' ' 27' ' ' VAL . 0.4 OUTLIER -81.0 -177.31 6.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.993 179.989 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.8 p -128.92 163.62 24.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.155 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.1 -36.77 51.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.927 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.773 HD13 HG21 ' B' ' 166' ' ' THR . 4.3 tp -71.65 -32.18 67.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.925 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -62.68 -48.67 78.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.81 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.633 HG13 ' CE2' ' A' ' 18' ' ' PHE . 21.4 t -75.06 -38.72 43.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.13 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -65.07 -41.5 95.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.843 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.2 m -51.7 -53.91 34.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.841 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -70.45 -42.05 72.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.834 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.481 HD23 ' O ' ' A' ' 27' ' ' VAL . 1.3 mm? -53.24 -33.54 53.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.898 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.69 -39.07 67.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.105 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -72.28 -48.89 39.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.08 -52.16 61.84 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.553 1.158 . . . . 0.0 108.33 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.602 ' CD2' HD11 ' B' ' 144' ' ' ILE . 23.6 tp -55.73 -45.85 77.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.9 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.06 -24.51 62.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.15 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -89.64 -34.69 16.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.898 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.2 t -96.99 113.01 24.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.936 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.0 t -63.52 -27.26 69.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.149 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -61.83 134.29 56.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.852 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -113.29 58.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.899 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 42' ' ' VAL . 17.0 m -82.39 119.66 32.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.09 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.83 131.03 35.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.138 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 29.5 p90 . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.871 179.966 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.943 0.401 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -124.1 -174.61 3.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.871 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 7.9 ptt? -100.01 173.79 6.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.918 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -118.15 157.18 27.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.915 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 103' ' ' ILE . . . . . 0.447 HD11 HG11 ' B' ' 117' ' ' VAL . 14.7 pt -145.06 166.47 11.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.075 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -124.45 152.97 42.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.885 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 105' ' ' VAL . . . . . 0.963 HG21 HD11 ' B' ' 130' ' ' ILE . 62.1 t -134.74 132.27 54.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.116 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -108.69 136.46 48.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.945 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 2.3 p -99.3 164.1 12.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.167 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.9 mp -66.79 -13.88 62.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.893 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 109' ' ' THR . . . . . 0.466 HG23 ' H ' ' B' ' 111' ' ' LYS . 5.1 t -90.2 -3.6 57.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.118 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 97.29 -27.55 18.03 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.471 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 111' ' ' LYS . . . . . 0.466 ' H ' HG23 ' B' ' 109' ' ' THR . 40.1 ttpt -52.49 140.22 23.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.814 0.34 . . . . 0.0 110.883 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 83.8 m -110.07 141.71 42.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.044 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 64.4 mt -125.36 141.99 43.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.164 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 13.9 m -125.69 110.33 13.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.15 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.618 HD11 ' HD3' ' B' ' 133' ' ' LYS . 11.6 mt -129.12 168.93 15.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -103.86 146.29 28.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.872 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.531 HG11 HG12 ' B' ' 126' ' ' VAL . 34.5 m -146.74 157.83 10.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.216 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 118' ' ' GLU . . . . . 0.413 ' HB3' ' HD2' ' B' ' 119' ' ' PRO . 8.0 mt-10 -100.83 155.6 36.14 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.622 0.725 . . . . 0.0 110.851 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 119' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' B' ' 118' ' ' GLU . 52.8 Cg_endo -69.78 -8.31 23.27 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.71 2.273 . . . . 0.0 112.326 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 3.6 m -109.56 -10.43 14.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.824 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -64.46 -174.03 0.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.854 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 22.9 p -130.55 176.52 8.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.101 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 123' ' ' ILE . . . . . 0.821 HG22 ' HE2' ' B' ' 127' ' ' LYS . 39.5 mm -65.3 -50.89 70.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.159 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -57.51 -20.3 30.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.857 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.84 -51.24 23.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.944 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 126' ' ' VAL . . . . . 0.74 HG22 ' O ' ' B' ' 123' ' ' ILE . 3.5 m -56.44 -24.76 19.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.101 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 127' ' ' LYS . . . . . 0.821 ' HE2' HG22 ' B' ' 123' ' ' ILE . 40.9 mttm -79.86 -31.79 40.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.892 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.59 -51.32 69.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.171 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.558 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -72.17 -39.97 68.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.82 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 130' ' ' ILE . . . . . 0.963 HD11 HG21 ' B' ' 105' ' ' VAL . 37.3 mt -58.06 -30.25 38.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.082 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -57.31 -45.13 84.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.901 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -71.97 -11.37 60.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.915 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 133' ' ' LYS . . . . . 0.618 ' HD3' HD11 ' B' ' 115' ' ' LEU . 0.1 OUTLIER -85.46 -66.13 0.93 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.895 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -85.07 -42.23 15.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.879 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.48 42.2 1.17 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.524 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -132.07 142.28 44.52 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.611 0.72 . . . . 0.0 111.089 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 143.84 52.06 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.68 2.253 . . . . 0.0 112.362 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 138' ' ' PRO . . . . . 0.413 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.8 Cg_endo -69.75 -12.68 33.41 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.624 2.216 . . . . 0.0 112.352 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -83.19 -1.07 52.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.91 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -121.86 -37.86 2.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.969 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 141' ' ' GLN . . . . . 0.528 ' OE1' HD11 ' B' ' 169' ' ' LEU . 18.0 pt20 -84.04 145.61 28.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.959 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 26.5 mmt85 -129.6 178.42 6.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.82 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 143' ' ' LEU . . . . . 0.744 HD21 HD22 ' B' ' 167' ' ' LEU . 6.6 tp -121.51 151.68 40.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.935 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.602 HD11 ' CD2' ' A' ' 35' ' ' LEU . 30.8 mm -139.65 110.36 4.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.109 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 145' ' ' PHE . . . . . 0.771 ' CB ' HD11 ' B' ' 150' ' ' LEU . 48.1 t80 -138.22 141.95 39.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.884 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 146' ' ' ALA . . . . . 0.566 ' O ' ' HB3' ' A' ' 7' ' ' ALA . . . 63.67 24.53 13.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.098 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 147' ' ' GLY . . . . . 0.497 ' HA3' HD21 ' A' ' 8' ' ' LEU . . . 71.48 13.34 74.13 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.439 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -123.54 166.27 15.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.729 0.299 . . . . 0.0 110.933 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -92.25 123.7 35.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.921 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.771 HD11 ' CB ' ' B' ' 145' ' ' PHE . 2.2 mt -96.91 130.99 44.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.898 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -128.09 170.14 13.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.843 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -60.78 -19.22 58.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.843 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -56.47 -22.24 37.63 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.497 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 15.9 mtt-85 -128.36 166.65 18.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.896 0.379 . . . . 0.0 110.883 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 69.8 p -101.2 -179.71 4.12 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.122 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 156' ' ' LEU . . . . . 0.496 HD13 HD12 ' B' ' 161' ' ' ILE . 3.9 mm? -64.97 -47.88 76.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.017 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 34.1 t -66.03 -15.72 63.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.815 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.79 -32.67 62.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.834 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 159' ' ' TYR . . . . . 0.523 ' CG ' HD22 ' B' ' 150' ' ' LEU . 37.1 m-85 -100.7 16.11 26.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.884 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 9.4 t30 59.17 34.64 23.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.882 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 161' ' ' ILE . . . . . 0.514 HD11 HD13 ' B' ' 150' ' ' LEU . 77.9 mt -80.94 95.57 2.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.147 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -90.16 -169.5 2.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.982 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -62.55 150.09 41.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.88 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 51.18 55.83 8.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.895 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 2.3 m -89.86 132.47 35.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.873 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 166' ' ' THR . . . . . 0.773 HG21 HD13 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -92.49 94.35 9.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.087 -179.911 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.744 HD22 HD21 ' B' ' 143' ' ' LEU . 2.8 mp -112.82 142.2 45.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.949 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -97.62 169.96 9.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.841 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 169' ' ' LEU . . . . . 0.528 HD11 ' OE1' ' B' ' 141' ' ' GLN . 4.7 tp -120.9 143.04 49.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.878 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 170' ' ' VAL . . . . . 0.568 HG21 HD23 ' A' ' 35' ' ' LEU . 26.0 t -132.93 112.71 18.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.146 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.77 114.79 29.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 172' ' ' ARG . . . . . 0.565 ' HD3' HG12 ' B' ' 170' ' ' VAL . 0.5 OUTLIER -111.33 77.89 1.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.878 179.928 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.29 113.99 3.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.904 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.2 141.21 57.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.792 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -57.82 102.69 0.25 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.445 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.375 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.452 -179.973 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.0 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.917 0.389 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -83.13 -38.49 22.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.927 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 18.2 mmt -109.34 177.92 4.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.828 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 167.31 89.67 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.479 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -97.76 72.47 2.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.779 0.323 . . . . 0.0 111.135 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.43 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . -170.51 154.94 4.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.053 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.42 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . -54.4 -34.41 61.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.117 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.84 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -133.09 133.38 42.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.919 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.66 2.04 49.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.917 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -154.26 125.55 7.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.818 -179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.6 t -51.98 108.02 0.97 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.679 0.752 . . . . 0.0 110.94 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -2.63 10.53 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.632 2.221 . . . . 0.0 112.346 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 15.6 mtm -93.08 -54.49 3.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.892 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.9 p -112.63 21.09 15.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.9 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 42.08 63.38 1.37 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.893 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -122.02 105.72 10.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.888 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -57.08 112.66 1.42 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.869 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.677 ' CE2' HG13 ' A' ' 27' ' ' VAL . 35.6 m-85 -66.27 153.56 42.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.861 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.91 152.74 47.75 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.564 0.697 . . . . 0.0 111.136 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 168.1 22.54 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.684 2.256 . . . . 0.0 112.325 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.57 40.69 0.65 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.817 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.502 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -82.41 -176.89 6.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.998 179.917 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.1 p -129.31 162.24 28.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.166 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 21.8 mm100 -51.09 -36.23 39.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.882 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.628 HD22 HG21 ' B' ' 166' ' ' THR . 17.0 tp -71.85 -34.27 69.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.916 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -60.09 -50.56 73.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.856 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.677 HG13 ' CE2' ' A' ' 18' ' ' PHE . 60.7 t -71.09 -30.27 40.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.134 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -71.21 -43.2 67.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.823 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.407 ' HA ' ' CE1' ' B' ' 168' ' ' HIS . 49.4 m -51.67 -53.98 33.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.893 -179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -68.26 -44.89 74.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.833 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.84 HD11 HD11 ' A' ' 8' ' ' LEU . 11.5 mt -52.47 -36.57 55.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.905 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.32 -41.68 96.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.125 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -74.06 -50.0 21.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.903 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.28 -42.23 69.79 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.473 1.108 . . . . 0.0 108.24 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.454 HD23 HG11 ' B' ' 170' ' ' VAL . 23.1 tp -64.66 -49.71 69.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.954 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.72 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -60.82 -23.1 64.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.066 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -93.71 -21.45 19.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.885 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.1 t -70.47 153.69 42.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.872 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -105.82 -17.68 14.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.192 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -114.18 132.75 55.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.887 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -88.97 70.34 8.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.884 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.7 m -81.84 127.09 39.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.159 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.1 m -90.32 118.25 29.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.18 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 33.4 p90 . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.887 -179.977 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 49.7 p . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.865 0.364 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -164.95 126.31 2.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.856 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.498 ' HE2' HG23 ' B' ' 117' ' ' VAL . 10.3 ptt? -106.51 172.45 6.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.938 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -127.76 159.68 34.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.924 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 41.5 pt -142.92 162.68 17.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.107 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -126.91 119.23 26.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.85 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 105' ' ' VAL . . . . . 0.68 HG11 HD23 ' B' ' 169' ' ' LEU . 21.9 t -108.31 118.52 56.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.137 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.08 126.54 43.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.898 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 79.0 p -64.42 173.68 1.99 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.145 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.6 tp -79.95 -1.16 38.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.935 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.7 t -105.93 -12.9 15.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.142 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 120.55 -25.45 7.28 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.453 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -48.68 138.63 10.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.809 0.338 . . . . 0.0 110.916 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 90.6 m -108.77 119.63 40.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.215 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 113' ' ' ILE . . . . . 0.53 HD11 ' CG ' ' B' ' 134' ' ' GLU . 62.3 mt -109.11 142.41 21.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.111 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 19.8 m -128.0 125.74 39.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.135 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.641 HD21 ' CE ' ' B' ' 133' ' ' LYS . 13.2 mt -146.99 159.48 43.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -96.79 140.68 31.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.875 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.623 HG11 HG12 ' B' ' 126' ' ' VAL . 34.0 m -144.43 156.58 14.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.126 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -103.95 161.61 22.43 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.623 0.725 . . . . 0.0 110.903 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 -24.43 29.64 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.716 2.278 . . . . 0.0 112.353 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 56.9 p -90.28 -12.35 38.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.828 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.466 ' C ' HD23 ' B' ' 156' ' ' LEU . 71.5 m-20 -61.57 -174.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.899 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 122' ' ' THR . . . . . 0.795 HG22 HG22 ' B' ' 155' ' ' THR . 33.8 p -137.25 162.16 34.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.21 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 123' ' ' ILE . . . . . 0.455 ' O ' HG22 ' B' ' 126' ' ' VAL . 41.8 mm -55.07 -34.72 32.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.159 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -72.39 -20.49 61.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -75.93 -52.78 9.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.925 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 126' ' ' VAL . . . . . 0.623 HG12 HG11 ' B' ' 117' ' ' VAL . 3.8 m -56.8 -28.23 27.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.165 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 9.6 mmtt -78.6 -29.62 46.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.923 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.47 -51.78 68.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.046 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.621 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -70.77 -39.63 73.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.927 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 130' ' ' ILE . . . . . 0.537 HD11 HG21 ' B' ' 105' ' ' VAL . 40.9 mt -54.88 -31.3 24.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.163 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -57.44 -43.19 83.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.899 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -72.67 -12.39 61.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.868 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 133' ' ' LYS . . . . . 0.641 ' CE ' HD21 ' B' ' 115' ' ' LEU . 3.2 mptp? -88.14 -64.39 1.15 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.941 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 134' ' ' GLU . . . . . 0.53 ' CG ' HD11 ' B' ' 113' ' ' ILE . 0.3 OUTLIER -81.91 -44.83 16.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.899 179.922 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.32 39.65 1.48 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.459 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 136' ' ' ILE . . . . . 0.434 HG12 HD21 ' B' ' 171' ' ' LEU . 0.0 OUTLIER -135.29 147.75 63.45 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.613 0.72 . . . . 0.0 111.152 -179.954 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 143.03 49.75 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.667 2.245 . . . . 0.0 112.367 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.68 -9.98 27.49 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.725 2.284 . . . . 0.0 112.369 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -83.6 -0.19 49.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.863 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 140' ' ' GLN . . . . . 0.437 ' HG2' HD13 ' B' ' 173' ' ' LEU . 3.0 mt-30 -120.85 -39.29 2.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.869 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 141' ' ' GLN . . . . . 0.573 ' HB2' HD11 ' B' ' 169' ' ' LEU . 20.1 pt20 -83.67 147.94 27.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.9 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 82.8 mtt180 -138.82 172.12 13.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 143' ' ' LEU . . . . . 0.667 HD22 HD22 ' B' ' 167' ' ' LEU . 5.9 mt -114.06 153.58 29.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.887 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.604 HD13 ' O ' ' B' ' 143' ' ' LEU . 23.5 mm -137.45 103.25 2.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.179 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 145' ' ' PHE . . . . . 0.745 ' CB ' HD11 ' B' ' 150' ' ' LEU . 9.8 t80 -138.47 147.52 43.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.883 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 146' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' B' ' 145' ' ' PHE . . . 67.56 24.03 8.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.091 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 147' ' ' GLY . . . . . 0.611 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 70.64 8.39 63.24 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.458 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.69 163.75 16.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.762 0.315 . . . . 0.0 110.916 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -89.1 109.83 20.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.896 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.745 HD11 ' CB ' ' B' ' 145' ' ' PHE . 3.6 mt -77.63 129.65 35.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.864 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -138.04 172.74 12.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.906 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -60.02 -19.21 51.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.87 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -57.27 -21.38 39.85 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.458 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 11.5 mtp180 -131.43 167.75 18.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.926 0.393 . . . . 0.0 110.865 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 155' ' ' THR . . . . . 0.795 HG22 HG22 ' B' ' 122' ' ' THR . 39.8 p -101.66 179.92 4.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.174 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 156' ' ' LEU . . . . . 0.85 HD13 HD12 ' B' ' 161' ' ' ILE . 4.2 mm? -65.87 -48.09 72.71 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.9 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 43.0 t -64.83 -20.59 66.48 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.856 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.2 -31.25 68.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.808 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 159' ' ' TYR . . . . . 0.49 ' CG ' HD22 ' B' ' 150' ' ' LEU . 36.2 m-85 -100.78 13.54 34.6 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.882 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 14.5 t30 50.81 44.58 27.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.878 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 161' ' ' ILE . . . . . 0.85 HD12 HD13 ' B' ' 156' ' ' LEU . 92.3 mt -83.03 111.15 18.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.167 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -93.79 -176.2 3.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.858 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 36.0 tttt -69.43 145.37 52.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.912 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 62.91 36.94 12.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.94 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 2.3 m -72.83 139.36 46.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.875 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 166' ' ' THR . . . . . 0.628 HG21 HD22 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -97.09 107.22 19.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.153 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.667 HD22 HD22 ' B' ' 143' ' ' LEU . 1.1 mp -126.5 172.85 9.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.91 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 168' ' ' HIS . . . . . 0.407 ' CE1' ' HA ' ' A' ' 29' ' ' SER . 1.9 m-70 -121.59 169.6 10.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.863 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 169' ' ' LEU . . . . . 0.68 HD23 HG11 ' B' ' 105' ' ' VAL . 0.2 OUTLIER -116.05 127.89 55.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.897 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 170' ' ' VAL . . . . . 0.72 HG13 ' HB2' ' A' ' 36' ' ' ALA . 16.1 t -125.53 114.21 38.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.09 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.511 HD12 HD12 ' B' ' 169' ' ' LEU . 0.0 OUTLIER -101.46 119.47 38.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.91 179.919 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 -111.06 96.46 6.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.892 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 173' ' ' LEU . . . . . 0.459 HD22 ' H ' ' B' ' 173' ' ' LEU . 1.5 mm? -84.72 145.72 27.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.906 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -75.76 102.77 5.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.853 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 151.88 -47.76 0.56 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.548 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.506 -179.987 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.483 ' C ' HD23 ' A' ' 8' ' ' LEU . . . . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.81 0.338 . . . . 0.0 111.077 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 1.117 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -151.97 143.39 23.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.876 -179.95 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.1 ttp85 -102.1 -16.04 16.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.889 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -137.47 124.4 21.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.838 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.4 t -51.24 106.64 0.68 Allowed Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 121.581 0.705 . . . . 0.0 110.925 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.76 -3.92 12.98 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.611 2.207 . . . . 0.0 112.307 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -90.03 -55.1 3.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.829 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.3 p -112.13 19.53 17.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.871 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 42.93 63.06 1.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.945 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.3 ttpt -125.89 113.78 17.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.884 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -61.83 120.41 10.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.896 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.624 ' HE2' HD12 ' A' ' 8' ' ' LEU . 57.5 m-85 -71.39 153.66 42.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.841 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.91 151.01 66.53 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.555 0.693 . . . . 0.0 111.128 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 170.57 16.31 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.671 2.247 . . . . 0.0 112.4 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 40.67 37.84 0.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.901 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.435 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.6 OUTLIER -83.61 -175.98 6.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.964 -179.983 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.6 p -132.29 162.32 31.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.167 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.44 -30.65 20.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.891 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.6 HD13 HG21 ' B' ' 166' ' ' THR . 9.2 tp -72.11 -37.14 69.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.972 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.28 -59.89 4.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.837 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.684 HG11 ' HG ' ' A' ' 8' ' ' LEU . 22.7 t -54.6 -48.64 70.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.139 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 49.9 m-20 -60.25 -43.43 96.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.854 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.4 m -51.97 -47.56 64.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.848 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -75.43 -40.8 57.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 1.117 HD11 HD11 ' A' ' 8' ' ' LEU . 26.7 mt -57.78 -28.58 64.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.909 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.403 ' HA ' HG21 ' B' ' 170' ' ' VAL . . . -73.44 -51.09 18.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.092 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.736 ' HA ' HD21 ' B' ' 108' ' ' LEU . 3.1 pt20 -68.45 -32.28 72.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.921 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 t -71.82 -49.25 40.21 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.476 1.11 . . . . 0.0 108.318 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.76 HD22 HD11 ' B' ' 144' ' ' ILE . 5.9 tp -52.35 -47.13 66.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.934 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.964 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -58.88 -38.52 79.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.049 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -73.84 -34.35 64.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.91 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.8 p -63.98 162.72 13.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.895 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 68.5 p -107.51 -24.72 11.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.194 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -104.16 125.7 50.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.861 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -94.21 59.54 2.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.881 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 32.8 m -74.33 149.97 7.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.119 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 51.4 m -98.05 112.21 24.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.143 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 36.8 p90 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.899 179.996 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 96.0 p . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.929 0.395 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -122.88 125.66 45.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.864 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 101' ' ' MET . . . . . 0.633 ' HE2' HG23 ' B' ' 117' ' ' VAL . 7.0 ptt? -101.49 155.47 18.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.908 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -103.66 154.86 19.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.903 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 103' ' ' ILE . . . . . 0.604 HD11 HG13 ' B' ' 126' ' ' VAL . 42.0 pt -147.35 155.22 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.166 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -122.53 143.43 49.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.86 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 105' ' ' VAL . . . . . 0.427 HG22 ' HB2' ' B' ' 167' ' ' LEU . 42.5 t -138.06 113.82 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.112 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -99.29 147.38 25.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.92 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 107' ' ' THR . . . . . 0.45 HG22 ' CB ' ' B' ' 169' ' ' LEU . 60.8 p -100.07 179.11 4.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.132 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . 0.736 HD21 ' HA ' ' A' ' 33' ' ' GLN . 6.7 mp -73.2 -9.79 59.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.874 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 50.9 p -90.89 -12.59 35.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.106 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 106.56 -22.17 31.07 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.472 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 111' ' ' LYS . . . . . 0.419 ' NZ ' HD11 ' B' ' 113' ' ' ILE . 26.0 ttpp -51.8 141.87 16.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.856 0.36 . . . . 0.0 110.915 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 6.5 m -118.95 117.5 28.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.136 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 113' ' ' ILE . . . . . 0.423 HD13 HG23 ' B' ' 130' ' ' ILE . 51.2 mt -102.03 134.39 42.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.17 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 95.2 m -119.16 109.89 16.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.117 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.67 HD21 ' CE ' ' B' ' 133' ' ' LYS . 19.9 mt -133.66 170.11 16.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.895 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -110.88 148.45 32.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.794 HG11 HG22 ' B' ' 126' ' ' VAL . 19.6 m -145.57 161.52 12.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.132 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -104.56 160.9 24.48 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-O 121.709 0.766 . . . . 0.0 110.835 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 -23.21 30.89 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.635 2.223 . . . . 0.0 112.365 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 15.0 p -93.62 -10.05 35.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.843 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 -66.69 -175.82 0.43 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.884 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 122' ' ' THR . . . . . 0.789 HG22 HG22 ' B' ' 155' ' ' THR . 37.9 p -133.21 165.37 24.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.126 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 123' ' ' ILE . . . . . 0.835 HG23 HD12 ' B' ' 143' ' ' LEU . 31.6 mm -55.12 -48.45 76.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.17 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.97 -34.39 63.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.912 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -43.75 94.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.875 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . 0.794 HG22 HG11 ' B' ' 117' ' ' VAL . 41.0 t -56.95 -32.61 39.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.146 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 127' ' ' LYS . . . . . 0.795 ' HE3' HG22 ' B' ' 123' ' ' ILE . 26.2 mttt -78.95 -28.87 43.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.89 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.59 -51.6 68.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.082 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.626 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -72.06 -37.31 69.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.933 179.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . 0.532 ' CG1' HD12 ' B' ' 115' ' ' LEU . 66.4 mt -61.22 -28.87 44.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.124 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -58.59 -43.49 89.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.921 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -70.98 -11.5 61.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.81 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 133' ' ' LYS . . . . . 0.67 ' CE ' HD21 ' B' ' 115' ' ' LEU . 4.4 mptp? -88.99 -66.41 0.92 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.933 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -81.85 -44.32 17.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.883 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.29 35.53 2.1 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.447 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . 0.71 HD13 HD11 ' B' ' 171' ' ' LEU . 0.9 OUTLIER -125.0 141.54 38.7 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.652 0.739 . . . . 0.0 111.1 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 143.53 50.98 Favored 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.652 2.235 . . . . 0.0 112.41 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 138' ' ' PRO . . . . . 0.411 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.7 Cg_endo -69.76 -12.81 33.67 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.714 2.276 . . . . 0.0 112.325 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -83.13 -1.59 53.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.84 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -122.09 -38.18 2.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.961 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . 0.563 ' HB2' HD11 ' B' ' 169' ' ' LEU . 15.3 pt20 -83.78 148.23 27.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.96 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 20.5 mmm-85 -132.44 176.82 8.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.874 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . 0.835 HD12 HG23 ' B' ' 123' ' ' ILE . 17.5 mt -125.36 147.79 49.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.896 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.76 HD11 HD22 ' A' ' 35' ' ' LEU . 23.2 mm -134.94 122.2 36.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.097 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 145' ' ' PHE . . . . . 0.765 ' HB3' HD11 ' B' ' 150' ' ' LEU . 53.0 t80 -157.76 144.48 17.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.894 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 62.86 27.97 16.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.072 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . 0.502 ' HA3' HD21 ' A' ' 8' ' ' LEU . . . 62.88 28.75 72.38 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.514 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -136.53 151.98 50.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.797 0.332 . . . . 0.0 110.914 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -81.8 109.54 16.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.87 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.765 HD11 ' HB3' ' B' ' 145' ' ' PHE . 3.8 mt -83.0 124.41 30.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.931 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -141.38 178.14 7.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.74 -19.06 58.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.928 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -58.08 -20.15 41.19 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.471 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 10.7 mtt180 -137.72 167.74 21.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.923 0.392 . . . . 0.0 110.851 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 155' ' ' THR . . . . . 0.789 HG22 HG22 ' B' ' 122' ' ' THR . 64.3 p -103.97 179.95 4.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.182 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 156' ' ' LEU . . . . . 0.542 HD13 HD12 ' B' ' 161' ' ' ILE . 4.3 mm? -63.01 -47.78 81.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.915 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 40.5 t -62.17 -18.85 62.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.869 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -70.63 -36.57 73.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.926 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 159' ' ' TYR . . . . . 0.54 ' CG ' HD22 ' B' ' 150' ' ' LEU . 62.4 m-85 -100.61 15.73 27.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.902 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 9.3 t30 52.42 36.19 19.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.817 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 161' ' ' ILE . . . . . 0.596 HD11 HD13 ' B' ' 150' ' ' LEU . 96.8 mt -75.43 101.92 2.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.081 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -91.55 -170.91 2.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.973 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 23.3 tttm -67.83 142.72 56.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.875 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 63.28 54.06 2.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 14.4 m -92.3 135.2 34.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.848 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 166' ' ' THR . . . . . 0.6 HG21 HD13 ' A' ' 25' ' ' LEU . 0.3 OUTLIER -90.07 93.45 9.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.165 -179.945 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.44 HD23 HD12 ' B' ' 150' ' ' LEU . 5.0 mp -106.38 159.54 16.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.92 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 5.1 m80 -112.87 169.59 8.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.848 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . 0.563 HD11 ' HB2' ' B' ' 141' ' ' GLN . 0.3 OUTLIER -121.35 128.89 52.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.967 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 170' ' ' VAL . . . . . 0.964 HG13 ' HB2' ' A' ' 36' ' ' ALA . 45.9 t -133.05 121.06 42.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.09 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.71 HD11 HD13 ' B' ' 136' ' ' ILE . 0.3 OUTLIER -105.71 119.29 38.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.962 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 19.8 mmm-85 -111.16 77.86 1.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.855 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 6.7 mt . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.944 -179.976 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.512 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.817 0.341 . . . . 0.0 111.086 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.822 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -143.28 139.05 29.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.935 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.78 8.54 28.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.855 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -155.32 124.2 6.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.898 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.423 ' HA ' ' HD2' ' A' ' 12' ' ' PRO . 22.2 t -51.8 107.75 0.9 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.573 0.701 . . . . 0.0 110.853 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 11' ' ' CYS . 53.4 Cg_endo -69.77 -1.1 7.9 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.652 2.235 . . . . 0.0 112.356 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -94.63 -54.3 3.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.869 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.6 p -114.78 21.58 14.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.903 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 42.55 69.09 0.41 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.97 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -125.85 105.42 8.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.937 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -57.17 112.02 1.24 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.859 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.684 ' CE2' HG13 ' A' ' 27' ' ' VAL . 31.0 m-85 -67.47 153.29 44.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.949 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.08 151.52 34.33 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.546 0.689 . . . . 0.0 111.119 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.64 168.7 20.63 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.739 2.293 . . . . 0.0 112.386 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.4 ptt-85 39.7 40.34 0.65 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.863 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.471 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -83.79 -176.27 6.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.923 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.9 p -128.63 163.59 24.72 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.1 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -53.01 -31.77 42.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.87 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 13.4 tp -71.9 -32.01 66.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.942 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.24 -60.4 3.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.854 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.684 HG13 ' CE2' ' A' ' 18' ' ' PHE . 67.2 t -54.76 -37.81 41.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.119 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.464 ' OD1' HG22 ' B' ' 144' ' ' ILE . 85.6 m-20 -72.14 -38.99 69.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.862 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.6 m -51.39 -53.98 31.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.85 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -71.55 -43.66 65.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.898 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.822 HD11 HD11 ' A' ' 8' ' ' LEU . 13.3 mt -52.39 -29.63 25.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.918 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.05 -41.77 63.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.139 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -74.14 -40.48 62.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.978 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.1 t -57.83 -41.44 82.29 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.471 1.107 . . . . 0.0 108.323 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.614 HD12 HD11 ' B' ' 144' ' ' ILE . 14.3 mt -64.91 -58.82 5.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.89 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.745 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -58.03 -22.14 48.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.091 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -90.07 -24.18 21.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.862 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 t -102.07 165.0 11.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.848 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.7 t -124.92 1.25 8.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.073 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -71.1 -42.44 69.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.879 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.6 t0 61.08 53.97 3.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.914 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 16.7 t -77.4 151.87 5.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.147 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 55.4 m -123.49 118.5 27.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.112 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 40.8 p90 . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.973 179.899 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 68.7 m . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.925 0.393 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -126.16 122.91 37.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.87 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.5 ptt? -106.4 168.49 9.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.875 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -120.29 156.84 30.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.921 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 103' ' ' ILE . . . . . 0.595 HG22 ' HB3' ' B' ' 165' ' ' SER . 24.6 pt -146.39 155.21 12.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.132 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -119.44 117.47 28.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.94 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 105' ' ' VAL . . . . . 0.625 HG21 HD11 ' B' ' 130' ' ' ILE . 66.9 t -106.42 122.06 59.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.092 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 2.3 ttmm -99.26 146.91 25.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.953 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 37.5 p -93.12 164.52 13.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.159 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 6.4 tp -61.94 -17.64 57.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.913 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.6 p -90.35 -12.72 36.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.15 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 109.65 -13.08 32.71 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.427 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 43.1 tttm -51.64 138.4 23.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.844 0.354 . . . . 0.0 110.865 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 24.8 m -105.35 124.3 49.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.146 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 72.5 mt -119.38 139.9 45.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.156 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 5.4 m -123.0 128.96 50.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.095 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.709 HD13 ' HG3' ' B' ' 129' ' ' LYS . 15.4 mt -149.78 170.33 18.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.856 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -108.38 151.91 25.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.896 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.698 HG11 HG22 ' B' ' 126' ' ' VAL . 6.4 m -148.62 175.06 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.076 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -125.6 160.99 53.21 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.706 0.765 . . . . 0.0 110.831 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 -26.57 27.3 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.678 2.252 . . . . 0.0 112.365 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.6 p -89.41 -15.89 32.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.861 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -63.51 -176.23 0.15 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.868 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 122' ' ' THR . . . . . 0.558 HG22 HG22 ' B' ' 155' ' ' THR . 17.4 p -133.41 170.95 14.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.185 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 123' ' ' ILE . . . . . 0.772 HG23 HD12 ' B' ' 143' ' ' LEU . 36.5 mm -60.5 -37.37 74.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.15 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -63.21 -33.16 74.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.911 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.88 -44.27 81.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.853 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . 0.698 HG22 HG11 ' B' ' 117' ' ' VAL . 41.9 t -56.34 -36.95 48.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.143 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -78.58 -28.36 45.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.933 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.75 -51.67 67.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.097 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.709 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -71.89 -37.39 70.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.955 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . 0.625 HD11 HG21 ' B' ' 105' ' ' VAL . 62.0 mt -59.31 -28.85 40.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.076 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -58.38 -43.74 88.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.89 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -70.23 -11.93 61.24 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.866 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 133' ' ' LYS . . . . . 0.605 ' CE ' HD21 ' B' ' 115' ' ' LEU . 4.9 mptp? -89.84 -66.07 0.96 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.869 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -80.7 -45.59 16.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.869 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.2 38.62 1.63 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.466 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . 0.935 HD13 HD11 ' B' ' 171' ' ' LEU . 0.4 OUTLIER -130.91 143.62 50.15 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.633 0.73 . . . . 0.0 111.12 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 142.93 49.2 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.715 2.276 . . . . 0.0 112.324 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 138' ' ' PRO . . . . . 0.41 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.7 Cg_endo -69.79 -12.35 32.66 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.686 2.258 . . . . 0.0 112.295 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -83.65 -0.75 51.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.83 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -121.88 -40.23 2.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.944 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . 0.493 ' HB2' HD11 ' B' ' 169' ' ' LEU . 15.9 pt20 -79.65 141.74 36.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.878 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -120.35 175.66 5.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.888 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . 0.772 HD12 HG23 ' B' ' 123' ' ' ILE . 12.3 mt -129.22 147.58 51.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.921 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.63 HD13 ' O ' ' B' ' 143' ' ' LEU . 17.6 mm -133.4 109.04 13.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.18 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 145' ' ' PHE . . . . . 0.753 ' CB ' HD11 ' B' ' 150' ' ' LEU . 28.5 t80 -143.01 145.63 33.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.943 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 63.93 25.11 13.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.084 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . 0.582 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 69.58 11.25 65.08 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.497 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 1.8 mtmt -125.61 152.02 45.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.694 0.283 . . . . 0.0 110.917 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -80.3 109.7 15.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.869 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.753 HD11 ' CB ' ' B' ' 145' ' ' PHE . 3.8 mt -76.12 141.87 41.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.891 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -147.81 170.61 17.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.909 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -60.83 -18.86 58.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.839 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.19 -17.38 45.37 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.535 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 15.3 mtt180 -133.62 167.58 20.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.911 0.386 . . . . 0.0 110.874 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 155' ' ' THR . . . . . 0.558 HG22 HG22 ' B' ' 122' ' ' THR . 71.7 p -104.2 -179.91 4.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.119 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 156' ' ' LEU . . . . . 0.791 HD13 HD12 ' B' ' 161' ' ' ILE . 4.5 mm? -65.62 -47.64 74.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 76.1 p -63.0 -23.86 67.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.886 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -68.72 -31.94 71.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.852 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 159' ' ' TYR . . . . . 0.455 ' CG ' HD22 ' B' ' 150' ' ' LEU . 38.9 m-85 -100.62 15.3 28.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.914 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 5.1 t30 51.14 32.11 7.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.895 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 161' ' ' ILE . . . . . 0.791 HD12 HD13 ' B' ' 156' ' ' LEU . 83.0 mt -72.76 103.82 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.085 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 67.5 mm-40 -93.47 -169.73 2.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.94 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 22.1 tttt -66.21 144.99 56.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 63.43 50.02 3.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . 0.595 ' HB3' HG22 ' B' ' 103' ' ' ILE . 1.5 t -87.27 122.49 31.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.896 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 1.4 m -90.68 113.81 25.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.124 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.71 HD23 ' HB2' ' B' ' 145' ' ' PHE . 0.4 OUTLIER -128.3 163.94 23.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.919 179.952 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -107.95 170.02 8.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.875 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . 0.552 ' CD1' HD12 ' B' ' 171' ' ' LEU . 0.6 OUTLIER -121.56 121.33 37.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.896 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 170' ' ' VAL . . . . . 0.745 HG13 ' HB2' ' A' ' 36' ' ' ALA . 17.6 t -124.11 109.93 24.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.07 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.935 HD11 HD13 ' B' ' 136' ' ' ILE . 0.1 OUTLIER -88.44 125.97 34.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.867 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 4.7 mtp180 -111.08 84.94 2.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.904 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 5.3 mt . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.954 179.991 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.485 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . . . . . . 0 C--O 1.233 0.197 0 CA-C-O 120.811 0.339 . . . . 0.0 111.089 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.953 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -141.94 150.11 41.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.846 -179.965 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.36 -10.12 16.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.906 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -146.19 127.56 14.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.898 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.4 t -51.16 106.67 0.68 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.577 0.704 . . . . 0.0 110.9 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 -2.22 9.74 Favored 'Trans proline' 0 N--CA 1.465 -0.196 0 C-N-CA 122.745 2.297 . . . . 0.0 112.431 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 5.9 mtm -93.42 -54.86 3.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.877 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 15.2 p -114.06 22.38 13.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.901 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 41.58 70.31 0.28 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.902 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.0 tppt? -128.08 106.7 9.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.833 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -60.7 115.13 3.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.897 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.636 ' HE2' HD12 ' A' ' 8' ' ' LEU . 54.1 m-85 -70.99 153.8 42.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.847 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.59 151.97 68.61 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.596 0.712 . . . . 0.0 111.068 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.85 171.86 13.78 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.599 2.199 . . . . 0.0 112.286 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.79 37.87 0.39 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.893 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.435 ' C ' HD12 ' A' ' 22' ' ' LEU . 0.6 OUTLIER -83.99 -175.86 6.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.972 179.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 80.8 p -131.27 163.89 26.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.18 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -50.85 -31.84 18.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.863 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 1.014 HD12 HG21 ' B' ' 166' ' ' THR . 10.1 tt -72.18 -38.86 69.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.883 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -57.77 -46.69 84.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.861 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.568 HG11 ' HG ' ' A' ' 8' ' ' LEU . 18.7 t -72.05 -54.62 16.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.091 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -52.99 -43.01 66.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.87 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.6 m -51.38 -49.19 62.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.829 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -73.66 -45.95 49.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.802 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.953 HD11 HD11 ' A' ' 8' ' ' LEU . 62.4 mt -54.27 -25.67 24.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.922 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.41 -51.33 17.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.117 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -70.52 -31.57 68.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.928 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 t -73.28 -35.35 66.13 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.512 1.133 . . . . 0.0 108.263 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.811 HD22 HD11 ' B' ' 144' ' ' ILE . 45.7 tp -62.14 -52.07 65.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.874 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.822 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -55.78 -36.35 67.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.064 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -82.88 -16.07 48.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.864 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.3 p -67.51 136.38 54.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.867 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 51.9 m -63.11 -52.67 61.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.2 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -117.16 129.29 55.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.953 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -74.46 74.3 1.92 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.878 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.2 p -76.64 151.76 5.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.136 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.2 m -99.68 110.87 23.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.149 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 39.2 p90 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.859 -179.972 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 4.6 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.984 0.421 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -88.64 116.09 26.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.946 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 10.9 ptt? -91.73 167.84 11.89 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.868 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -121.26 136.91 54.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.968 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 103' ' ' ILE . . . . . 0.441 HD13 HG21 ' B' ' 117' ' ' VAL . 46.9 pt -124.85 155.18 33.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.126 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -116.03 115.92 26.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.838 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 105' ' ' VAL . . . . . 0.753 HG21 HD11 ' B' ' 130' ' ' ILE . 98.8 t -96.94 110.34 24.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.101 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -99.29 112.14 24.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.881 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 15.5 p -64.24 169.41 4.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.217 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 27.6 tp -73.61 -8.09 54.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.885 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 30.7 p -93.9 -12.8 28.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.179 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 111.65 -15.64 26.67 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.447 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 19.2 tptt -51.49 139.86 19.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.78 0.324 . . . . 0.0 110.981 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 12.5 m -113.19 104.07 11.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.207 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 113' ' ' ILE . . . . . 0.638 ' CD1' HG23 ' B' ' 130' ' ' ILE . 15.0 mt -100.04 141.78 16.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.151 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 25.9 m -120.34 107.98 13.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.106 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.724 HD13 ' HB2' ' B' ' 129' ' ' LYS . 38.1 mt -124.43 171.64 9.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.906 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -120.51 128.76 53.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.722 HG11 HG22 ' B' ' 126' ' ' VAL . 17.2 m -127.64 -179.61 2.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.101 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -131.01 161.18 63.19 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.614 0.721 . . . . 0.0 110.917 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 -10.73 29.29 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.699 2.266 . . . . 0.0 112.328 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 2.1 p -104.33 -22.01 13.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.871 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -59.17 -175.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.854 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 122' ' ' THR . . . . . 0.648 HG22 HG22 ' B' ' 155' ' ' THR . 22.1 p -133.31 163.04 30.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.155 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 123' ' ' ILE . . . . . 1.016 HG23 HD12 ' B' ' 143' ' ' LEU . 37.8 mm -56.18 -44.15 78.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.14 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -52.69 -33.89 49.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.841 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.9 -44.41 80.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.962 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . 0.722 HG22 HG11 ' B' ' 117' ' ' VAL . 21.5 t -60.6 -27.87 41.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.147 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 127' ' ' LYS . . . . . 0.585 ' HE3' HG22 ' B' ' 123' ' ' ILE . 93.4 mttt -78.97 -29.47 43.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.891 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -71.38 -30.79 66.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.172 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.724 ' HB2' HD13 ' B' ' 115' ' ' LEU . 0.3 OUTLIER -77.5 -49.32 15.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.858 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . 0.753 HD11 HG21 ' B' ' 105' ' ' VAL . 31.8 mt -53.87 -31.04 20.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.154 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -59.23 -36.83 76.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.887 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.84 -12.47 60.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.83 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 133' ' ' LYS . . . . . 0.418 ' HD3' HD21 ' B' ' 115' ' ' LEU . 2.8 mptp? -96.71 -65.86 0.94 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.924 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 134' ' ' GLU . . . . . 0.62 ' CG ' HD11 ' B' ' 113' ' ' ILE . 0.9 OUTLIER -75.96 -45.31 35.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.908 179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.21 19.97 7.74 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.453 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -110.27 144.08 29.38 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.579 0.704 . . . . 0.0 111.124 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 144.27 53.41 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.655 2.237 . . . . 0.0 112.345 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 138' ' ' PRO . . . . . 0.405 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.5 Cg_endo -69.81 -12.87 33.67 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.638 2.225 . . . . 0.0 112.283 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -82.79 -1.38 51.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.909 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -122.18 -37.72 2.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . 0.628 ' OE1' HD11 ' B' ' 169' ' ' LEU . 17.7 pt20 -84.95 140.94 30.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.912 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 15.1 mmt85 -122.81 179.88 4.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . 1.016 HD12 HG23 ' B' ' 123' ' ' ILE . 11.7 mt -127.51 146.19 50.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.905 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.811 HD11 HD22 ' A' ' 35' ' ' LEU . 24.7 mm -136.9 129.94 45.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.141 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 145' ' ' PHE . . . . . 0.809 ' HB3' HD11 ' B' ' 150' ' ' LEU . 43.0 t80 -169.24 146.16 3.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.878 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 64.79 24.29 12.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.115 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . 0.481 ' HA3' HD21 ' A' ' 8' ' ' LEU . . . 65.67 28.8 73.97 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.472 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -141.57 154.37 45.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.742 0.306 . . . . 0.0 110.917 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -81.95 109.51 16.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.945 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.809 HD11 ' HB3' ' B' ' 145' ' ' PHE . 3.6 mt -80.67 125.34 29.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.885 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -139.32 178.84 6.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.9 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.19 -16.55 60.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.818 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.96 -16.88 49.49 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.482 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 16.9 mtt180 -139.71 167.76 21.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.942 0.401 . . . . 0.0 110.808 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 155' ' ' THR . . . . . 0.648 HG22 HG22 ' B' ' 122' ' ' THR . 24.2 p -103.77 179.93 4.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.116 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 156' ' ' LEU . . . . . 0.67 HD13 HD12 ' B' ' 161' ' ' ILE . 4.4 mm? -63.46 -47.88 80.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.95 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 77.8 p -62.96 -17.03 61.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.948 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -71.84 -35.89 70.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.846 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 159' ' ' TYR . . . . . 0.548 ' CG ' HD22 ' B' ' 150' ' ' LEU . 68.8 m-85 -100.62 14.93 29.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.936 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 21.5 t30 51.2 41.74 28.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.938 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 161' ' ' ILE . . . . . 0.67 HD12 HD13 ' B' ' 156' ' ' LEU . 92.2 mt -80.87 104.99 10.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.131 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -93.92 -175.01 3.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.939 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 6.6 tttt -60.56 152.37 26.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.967 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 52.08 53.01 13.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.6 m -93.34 129.16 39.56 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.85 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 166' ' ' THR . . . . . 1.014 HG21 HD12 ' A' ' 25' ' ' LEU . 3.2 m -79.08 84.93 5.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.129 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.725 HD23 ' HB2' ' B' ' 145' ' ' PHE . 7.5 mt -96.98 124.96 41.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.879 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 14.2 m80 -89.57 168.43 12.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.898 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . 0.628 HD11 ' OE1' ' B' ' 141' ' ' GLN . 1.5 tp -126.14 143.19 51.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.878 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 170' ' ' VAL . . . . . 0.822 HG13 ' HB2' ' A' ' 36' ' ' ALA . 43.8 t -134.68 119.45 28.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.119 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.58 113.25 26.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.862 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 13.8 ttt-85 -111.31 77.85 1.07 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.811 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 2.0 mp . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.899 -179.959 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.541 ' C ' HD23 ' A' ' 8' ' ' LEU . . . . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.792 0.33 . . . . 0.0 111.135 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.614 HD21 ' O ' ' B' ' 147' ' ' GLY . 0.3 OUTLIER -125.29 164.58 20.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.907 -179.928 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.3 -17.42 10.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.904 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 2.0 m -152.61 127.78 9.79 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.847 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HA ' ' HD2' ' A' ' 12' ' ' PRO . 15.5 t -51.89 107.99 0.96 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.56 0.695 . . . . 0.0 110.892 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.416 ' HD2' ' HA ' ' A' ' 11' ' ' CYS . 53.4 Cg_endo -69.82 -2.87 10.94 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.605 2.203 . . . . 0.0 112.383 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtm -91.64 -54.32 3.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.931 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.8 p -113.29 20.39 16.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.928 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.08 61.13 2.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.915 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.8 ttpt -121.67 107.22 12.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -54.33 118.42 4.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.863 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.447 ' HB3' HD23 ' A' ' 22' ' ' LEU . 41.7 m-85 -70.19 152.6 44.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.891 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.71 148.8 74.25 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.535 0.683 . . . . 0.0 111.088 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 168.96 20.05 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.649 2.233 . . . . 0.0 112.368 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.3 ptt180 39.59 40.5 0.63 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.925 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.447 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -84.72 -176.5 6.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.85 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.45 161.8 28.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.122 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -50.5 -36.27 33.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.8 tt -72.13 -38.95 69.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.911 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 83.2 m-20 -52.97 -50.74 63.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.868 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.429 HG12 ' CD2' ' A' ' 31' ' ' LEU . 19.4 t -66.25 -53.58 35.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.148 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -50.99 -32.77 22.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.873 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.5 m -59.45 -54.93 40.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.859 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -71.42 -34.73 70.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.429 ' CD2' HG12 ' A' ' 27' ' ' VAL . 1.1 mp -53.09 -47.1 68.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.867 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.466 ' HA ' HG21 ' B' ' 170' ' ' VAL . . . -68.24 -33.41 74.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.09 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -73.79 -31.65 63.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.936 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -76.25 -54.63 6.51 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.489 1.118 . . . . 0.0 108.301 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.778 HD22 HG11 ' B' ' 170' ' ' VAL . 5.2 tt -51.26 -57.67 8.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.888 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.895 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -55.46 -32.2 62.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.139 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -78.19 -21.78 49.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 92.5 p -93.92 175.23 6.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.877 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.9 m -124.86 4.37 8.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.186 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -101.32 151.3 22.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.847 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -105.31 57.3 0.68 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.854 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 10.2 p -77.16 149.93 6.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.091 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.9 m -117.0 114.22 23.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.131 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.442 ' HH2' HD12 ' A' ' 35' ' ' LEU . 36.8 p90 . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.96 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 46.4 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.915 0.388 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -133.94 126.16 29.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.851 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.6 ptt? -107.57 170.38 8.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.903 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -123.66 139.64 53.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.925 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 103' ' ' ILE . . . . . 0.45 HG12 HG22 ' B' ' 117' ' ' VAL . 29.0 pt -127.97 170.68 17.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.116 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . 0.6 ' CE2' HG23 ' B' ' 114' ' ' THR . 47.9 m-85 -128.91 138.59 52.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.844 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 105' ' ' VAL . . . . . 0.852 HG21 HD11 ' B' ' 130' ' ' ILE . 58.1 t -118.52 111.54 34.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.093 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.52 117.15 33.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.882 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 107' ' ' THR . . . . . 0.593 ' OG1' HG22 ' B' ' 109' ' ' THR . 11.1 p -73.15 172.72 10.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.13 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 15.2 mt -79.46 -1.61 38.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.967 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . 0.593 HG22 ' OG1' ' B' ' 107' ' ' THR . 14.6 t -90.12 -12.49 38.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.108 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 100.34 14.99 31.34 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.549 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -97.11 145.44 26.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.871 0.367 . . . . 0.0 110.96 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 2.6 m -109.44 137.0 47.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.227 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 62.7 mt -127.53 142.28 44.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.136 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 114' ' ' THR . . . . . 0.6 HG23 ' CE2' ' B' ' 104' ' ' PHE . 1.3 m -119.76 130.86 55.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.115 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.501 HD13 ' HB2' ' B' ' 129' ' ' LYS . 13.6 mt -149.33 171.3 16.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.934 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -110.07 147.99 32.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.904 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.454 HG11 HG22 ' B' ' 126' ' ' VAL . 11.1 m -148.66 179.69 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.127 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -141.88 160.94 53.98 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.589 0.709 . . . . 0.0 110.931 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 -12.8 33.67 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.701 2.267 . . . . 0.0 112.312 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.4 p -99.12 -22.78 15.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.867 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -62.12 -172.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.892 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 122' ' ' THR . . . . . 0.536 ' CG2' HG22 ' B' ' 155' ' ' THR . 1.4 p -133.9 169.46 17.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.075 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 123' ' ' ILE . . . . . 0.74 HG23 HD12 ' B' ' 143' ' ' LEU . 40.8 mm -61.91 -49.06 85.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.152 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -52.51 -35.61 53.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.906 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -50.31 74.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.887 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . 0.454 HG22 HG11 ' B' ' 117' ' ' VAL . 22.9 t -56.47 -25.09 20.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.146 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -77.42 -27.67 52.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.893 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.22 -30.33 54.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.072 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.501 ' HB2' HD13 ' B' ' 115' ' ' LEU . 0.1 OUTLIER -77.63 -29.03 51.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.83 -179.898 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . 0.852 HD11 HG21 ' B' ' 105' ' ' VAL . 46.6 mt -77.39 -28.33 16.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.135 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -53.82 -48.23 70.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.885 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -68.81 -11.78 60.8 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.793 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 133' ' ' LYS . . . . . 0.431 ' HD3' HD21 ' B' ' 115' ' ' LEU . 6.8 mptt -93.09 -66.07 0.95 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.928 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.16 -45.79 17.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.832 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.82 35.67 1.98 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.463 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . 0.756 HD13 HD11 ' B' ' 171' ' ' LEU . 0.5 OUTLIER -127.87 142.88 45.73 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.594 0.711 . . . . 0.0 111.131 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 145.64 57.42 Favored 'Trans proline' 0 C--O 1.231 0.132 0 C-N-CA 122.708 2.272 . . . . 0.0 112.302 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 138' ' ' PRO . . . . . 0.415 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 54.0 Cg_endo -69.78 -13.18 34.26 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.724 2.282 . . . . 0.0 112.324 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -82.8 -1.03 50.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.813 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -122.27 -38.12 2.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.924 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . 0.502 ' OE1' HD21 ' B' ' 169' ' ' LEU . 14.9 pt20 -83.72 153.88 23.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.913 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 19.0 mmt85 -138.33 179.64 6.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.9 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . 0.78 HD22 ' HB3' ' B' ' 167' ' ' LEU . 21.2 mt -129.99 152.43 49.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.893 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.599 HD13 ' O ' ' B' ' 143' ' ' LEU . 23.8 mm -137.24 118.31 17.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.13 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 145' ' ' PHE . . . . . 0.744 ' CB ' HD11 ' B' ' 150' ' ' LEU . 26.2 t80 -155.6 146.89 22.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.879 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 65.41 23.41 11.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.063 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . 0.614 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 66.01 29.36 74.84 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.466 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -143.0 154.8 44.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.799 0.333 . . . . 0.0 110.853 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -78.23 109.8 12.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.902 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.744 HD11 ' CB ' ' B' ' 145' ' ' PHE . 5.2 mt -77.25 133.75 38.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.863 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -154.67 173.16 16.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.949 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.89 -25.5 11.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.805 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -50.35 -28.36 13.93 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.51 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 13.9 mtt-85 -137.15 147.58 46.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.884 0.373 . . . . 0.0 110.92 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 155' ' ' THR . . . . . 0.536 HG22 ' CG2' ' B' ' 122' ' ' THR . 30.2 p -82.66 -179.48 7.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.123 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 156' ' ' LEU . . . . . 0.476 HD13 HD12 ' B' ' 161' ' ' ILE . 4.4 mm? -63.07 -47.52 82.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.882 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 27.9 p -59.53 -32.28 70.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.936 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -59.69 -30.86 69.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.843 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -100.61 11.74 38.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.929 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 10.4 t30 51.37 30.33 5.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.903 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 161' ' ' ILE . . . . . 0.476 HD12 HD13 ' B' ' 156' ' ' LEU . 72.1 mt -68.98 110.45 2.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.16 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 61.0 mm-40 -93.34 -169.75 2.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.969 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 32.6 tttt -70.22 155.58 40.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.926 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 51.88 52.06 15.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.868 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.2 p -87.13 152.87 21.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.825 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.5 84.19 1.93 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.123 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.78 ' HB3' HD22 ' B' ' 143' ' ' LEU . 2.5 mt -94.42 140.58 29.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.957 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -93.09 155.57 17.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.867 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . 0.54 ' HB3' HG22 ' B' ' 107' ' ' THR . 0.4 OUTLIER -114.64 117.49 31.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 -179.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 170' ' ' VAL . . . . . 0.895 HG13 ' HB2' ' A' ' 36' ' ' ALA . 90.6 t -121.98 127.65 75.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.176 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.756 HD11 HD13 ' B' ' 136' ' ' ILE . 0.1 OUTLIER -109.21 119.81 40.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.886 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -111.26 77.85 1.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.839 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 16.6 mt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.917 179.981 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.567 ' C ' HD23 ' A' ' 8' ' ' LEU . . . . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.816 0.341 . . . . 0.0 111.105 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.913 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -143.18 137.62 29.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.935 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -102.24 -3.99 26.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.856 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -148.47 123.8 10.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.854 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HA ' ' HD2' ' A' ' 12' ' ' PRO . 7.9 t -51.68 107.34 0.8 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.575 0.702 . . . . 0.0 110.955 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 11' ' ' CYS . 53.7 Cg_endo -69.74 -2.9 10.94 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.684 2.256 . . . . 0.0 112.318 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 28.1 mtm -92.35 -55.07 3.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.928 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.3 p -110.59 18.2 19.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.881 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 43.79 61.25 2.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.946 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.408 ' HZ1' ' HD1' ' A' ' 18' ' ' PHE . 10.4 ttpt -123.2 111.22 16.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.908 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -59.6 116.48 4.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.854 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.499 ' CE2' HG13 ' A' ' 27' ' ' VAL . 45.4 m-85 -68.26 153.17 44.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.871 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.4 ' O ' HD23 ' A' ' 22' ' ' LEU . . . -58.38 150.26 55.36 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.598 0.713 . . . . 0.0 111.059 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 169.21 19.4 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.665 2.243 . . . . 0.0 112.38 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.8 ptt85 39.94 39.66 0.62 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.897 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.425 ' C ' HD12 ' A' ' 22' ' ' LEU . 0.8 OUTLIER -83.8 -176.4 6.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.922 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.3 p -129.25 162.55 27.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.206 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -51.89 -34.27 40.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.892 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.516 ' O ' HD13 ' A' ' 25' ' ' LEU . 0.3 OUTLIER -72.26 -32.91 67.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.938 179.992 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -61.3 -55.79 27.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.839 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.499 HG13 ' CE2' ' A' ' 18' ' ' PHE . 98.4 t -64.89 -32.45 58.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.137 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -71.41 -34.21 70.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.828 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 75.6 m -61.39 -53.84 51.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.869 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -69.75 -40.52 76.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.859 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.913 HD11 HD11 ' A' ' 8' ' ' LEU . 11.4 mt -52.09 -50.02 62.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.901 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.424 ' HB2' ' HB3' ' B' ' 168' ' ' HIS . . . -52.97 -50.71 63.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.086 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -62.36 -52.05 65.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.921 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -38.93 64.97 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.526 1.141 . . . . 0.0 108.334 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.685 ' HB3' HG11 ' B' ' 170' ' ' VAL . 0.4 OUTLIER -56.24 -58.34 8.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.907 179.945 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.832 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -57.75 -29.86 65.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.088 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -93.1 7.19 45.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.905 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 t -82.25 129.74 34.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.904 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 17.6 p -67.79 -24.44 65.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.105 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -139.64 128.09 22.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.855 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -81.36 83.35 6.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.872 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.8 m -99.22 173.28 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.128 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.1 m -122.3 128.17 50.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.19 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 41.2 p90 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.001 179.928 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.927 0.394 . . . . 0.0 110.868 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 6.7 p-80 -117.99 -175.35 2.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.833 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 7.4 ptt? -98.58 173.56 6.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.838 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -123.67 157.19 34.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.904 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 103' ' ' ILE . . . . . 0.53 HD13 HG21 ' B' ' 117' ' ' VAL . 31.7 pt -143.49 163.28 16.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.109 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -123.18 115.88 22.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.871 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 105' ' ' VAL . . . . . 0.887 HG21 HD11 ' B' ' 130' ' ' ILE . 44.7 t -104.87 120.04 54.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.128 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -112.24 140.43 46.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 107' ' ' THR . . . . . 0.666 HG22 HD22 ' B' ' 169' ' ' LEU . 43.9 p -94.61 -179.25 4.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.137 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . 0.546 HD13 ' O ' ' B' ' 169' ' ' LEU . 6.1 mp -78.1 -3.47 42.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.866 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 29.6 p -90.45 -1.74 57.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.183 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 92.69 -19.91 48.2 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.389 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 14.2 ttmm -61.16 139.32 58.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.835 0.35 . . . . 0.0 110.949 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 4.7 m -112.57 125.33 54.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.154 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 51.6 mt -110.0 142.47 22.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.151 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 29.1 m -124.15 107.56 11.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.189 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.774 HD13 ' HG3' ' B' ' 129' ' ' LYS . 11.6 mt -127.28 165.41 19.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.907 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -102.28 144.31 30.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.862 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.581 HG11 HG22 ' B' ' 126' ' ' VAL . 10.9 m -140.76 153.84 21.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.157 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -99.51 156.23 35.62 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.706 0.765 . . . . 0.0 110.907 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.82 -13.88 35.13 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.666 2.244 . . . . 0.0 112.341 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 84.3 p -105.07 -9.33 17.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.918 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.425 ' C ' HD23 ' B' ' 156' ' ' LEU . 58.0 m-20 -68.16 -174.6 0.51 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.867 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 122' ' ' THR . . . . . 0.611 HG22 HG22 ' B' ' 155' ' ' THR . 24.2 p -132.45 175.18 9.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.175 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 123' ' ' ILE . . . . . 0.832 HG22 ' HE3' ' B' ' 127' ' ' LYS . 32.7 mm -62.79 -46.84 95.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.091 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -53.94 -32.77 54.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.876 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.24 -43.13 82.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.914 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . 0.581 HG22 HG11 ' B' ' 117' ' ' VAL . 42.6 t -56.18 -36.27 45.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.23 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 127' ' ' LYS . . . . . 0.832 ' HE3' HG22 ' B' ' 123' ' ' ILE . 40.0 mttt -78.79 -28.65 44.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.869 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.74 -51.88 67.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.049 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.774 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -71.33 -37.95 71.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.912 179.963 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . 0.887 HD11 HG21 ' B' ' 105' ' ' VAL . 57.3 mt -57.92 -29.18 35.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.136 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -57.27 -47.5 81.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.859 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -69.5 -11.49 60.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.828 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 133' ' ' LYS . . . . . 0.549 ' CE ' HD21 ' B' ' 115' ' ' LEU . 12.0 mptt -88.72 -66.49 0.91 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.844 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -83.34 -45.32 13.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.858 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 111.28 41.77 1.13 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.445 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . 0.489 HD13 HD11 ' B' ' 171' ' ' LEU . 0.7 OUTLIER -133.82 142.15 42.56 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.61 0.719 . . . . 0.0 111.092 -179.987 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 144.32 53.4 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.732 2.288 . . . . 0.0 112.297 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.84 -12.92 33.7 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.695 2.263 . . . . 0.0 112.269 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -83.0 -0.58 49.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.885 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -120.95 -38.4 2.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.87 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . 0.646 ' OE1' HD11 ' B' ' 169' ' ' LEU . 18.2 pt20 -83.62 154.2 23.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.972 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 41.5 mtt85 -135.53 174.78 10.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.839 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . 0.793 HD23 HD12 ' B' ' 150' ' ' LEU . 6.7 tp -121.83 153.96 37.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.894 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.556 HD13 ' O ' ' B' ' 143' ' ' LEU . 30.8 mm -139.62 108.33 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.094 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 145' ' ' PHE . . . . . 0.784 ' HB2' HD23 ' B' ' 167' ' ' LEU . 23.6 t80 -144.87 146.28 31.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.859 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 64.07 23.4 13.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.099 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . 0.626 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 72.73 6.07 65.99 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.488 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.6 155.52 36.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.72 0.295 . . . . 0.0 110.897 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -83.68 111.78 19.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.899 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.793 HD12 HD23 ' B' ' 143' ' ' LEU . 1.6 mt -79.16 135.63 36.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.915 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -139.88 177.58 7.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.884 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -63.24 -16.98 61.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.822 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.4 -17.29 46.65 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.483 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 8.4 mtt180 -136.85 167.51 21.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.827 0.346 . . . . 0.0 110.898 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 155' ' ' THR . . . . . 0.611 HG22 HG22 ' B' ' 122' ' ' THR . 74.0 p -103.17 -179.7 4.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.073 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 156' ' ' LEU . . . . . 0.791 HD13 HD12 ' B' ' 161' ' ' ILE . 4.5 mm? -65.37 -47.86 74.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.953 179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 16.1 t -65.7 -18.27 65.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.838 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.23 -31.18 63.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.847 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 159' ' ' TYR . . . . . 0.505 ' CG ' HD22 ' B' ' 150' ' ' LEU . 33.3 m-85 -100.4 13.42 34.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.932 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 160' ' ' ASN . . . . . 0.472 ' ND2' HE22 ' B' ' 162' ' ' GLN . 17.0 t30 50.82 43.74 28.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.877 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 161' ' ' ILE . . . . . 0.791 HD12 HD13 ' B' ' 156' ' ' LEU . 92.1 mt -82.22 108.3 15.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.135 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 162' ' ' GLN . . . . . 0.472 HE22 ' ND2' ' B' ' 160' ' ' ASN . 14.7 mp0 -89.34 178.51 6.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.894 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 30.5 tttm -64.84 150.93 46.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.884 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 59.49 34.85 22.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.96 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.8 m -75.9 135.23 40.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.88 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.51 110.15 22.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.059 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.784 HD23 ' HB2' ' B' ' 145' ' ' PHE . 0.5 OUTLIER -121.75 155.54 35.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.882 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 168' ' ' HIS . . . . . 0.424 ' HB3' ' HB2' ' A' ' 32' ' ' ALA . 1.1 m80 -103.18 151.16 22.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.829 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . 0.666 HD22 HG22 ' B' ' 107' ' ' THR . 3.4 tp -109.61 147.57 32.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.891 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 170' ' ' VAL . . . . . 0.832 HG13 ' HB2' ' A' ' 36' ' ' ALA . 25.3 t -142.95 126.43 14.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.153 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.489 HD11 HD13 ' B' ' 136' ' ' ILE . 0.4 OUTLIER -106.22 119.8 40.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.925 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.15 77.85 1.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.829 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 12.4 mt . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.898 -179.985 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.451 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.853 0.358 . . . . 0.0 111.063 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.935 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -139.74 157.37 45.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.876 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -123.46 10.22 9.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.839 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.3 m -154.49 119.26 4.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.854 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 35.1 t -51.31 107.25 0.78 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.569 0.699 . . . . 0.0 110.879 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.408 ' HD2' HD21 ' A' ' 31' ' ' LEU . 53.0 Cg_endo -69.77 -2.51 10.31 Favored 'Trans proline' 0 N--CA 1.465 -0.188 0 C-N-CA 122.693 2.262 . . . . 0.0 112.348 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.4 ttm -91.45 -53.76 4.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.875 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.3 p -116.08 21.55 13.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.898 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.04 67.54 0.62 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.939 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 tppt? -124.41 107.71 11.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.877 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -59.23 112.1 1.59 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.839 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.68 ' CE2' HG13 ' A' ' 27' ' ' VAL . 41.5 m-85 -64.59 152.81 41.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.84 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -71.66 148.23 92.56 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.521 0.677 . . . . 0.0 111.114 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 167.97 22.95 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.626 2.217 . . . . 0.0 112.335 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 60.46 17.74 7.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.459 ' C ' HD12 ' A' ' 22' ' ' LEU . 0.6 OUTLIER -76.8 -174.9 3.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.949 -179.986 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.2 p -139.8 169.9 16.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.181 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -52.2 -34.36 45.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.895 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 13.8 tp -72.19 -31.9 66.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.899 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.57 -60.54 3.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.872 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.68 HG13 ' CE2' ' A' ' 18' ' ' PHE . 21.0 t -57.15 -36.51 51.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.153 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -71.65 -41.01 69.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.876 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.5 m -51.54 -53.79 34.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.897 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -68.52 -49.98 55.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.893 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.935 HD11 HD11 ' A' ' 8' ' ' LEU . 12.6 mt -53.12 -25.54 13.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.874 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.08 -49.85 33.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.124 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -30.98 63.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.937 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.6 t -71.37 -23.08 61.83 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.454 1.096 . . . . 0.0 108.325 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 45.3 tp -84.93 -50.06 7.82 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.907 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.997 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -66.94 -15.9 63.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.071 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.32 -25.38 14.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.903 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 56.7 p -72.54 168.2 19.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.862 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.43 4.13 13.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.192 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -117.72 159.17 23.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.885 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -124.77 65.17 1.11 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.906 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 20.7 m -89.53 133.97 30.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.188 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.0 m -99.7 119.74 38.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.159 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.472 ' HZ2' HD13 ' A' ' 31' ' ' LEU . 36.8 p90 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.909 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.899 0.38 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -116.33 114.31 24.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.893 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.7 ptt? -96.07 164.73 12.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.899 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -115.29 158.95 21.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.968 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 22.8 pt -149.76 155.25 8.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.122 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -121.95 141.25 51.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.934 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 105' ' ' VAL . . . . . 0.812 HG11 HD23 ' B' ' 169' ' ' LEU . 93.1 t -131.58 113.58 23.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.161 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -99.26 132.91 44.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 107' ' ' THR . . . . . 0.41 HG22 ' HB3' ' B' ' 169' ' ' LEU . 68.0 p -87.44 175.75 7.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.099 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 13.6 mt -73.74 -10.3 59.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.902 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 24.4 p -90.38 -12.72 36.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.066 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 107.59 -14.72 38.65 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.464 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 2.9 ttmp? -51.8 148.29 5.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.966 0.412 . . . . 0.0 110.893 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 23.1 m -125.69 104.07 8.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.177 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 57.0 mt -96.93 141.99 14.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.146 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 90.6 m -130.05 108.83 10.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.21 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.681 HD13 ' HG3' ' B' ' 129' ' ' LYS . 13.8 mt -130.18 170.48 14.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.83 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -114.43 148.14 38.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.845 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.776 HG11 HG22 ' B' ' 126' ' ' VAL . 11.0 m -140.12 178.75 3.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.174 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -122.05 160.57 46.78 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.58 0.705 . . . . 0.0 110.886 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 -20.68 34.18 Favored 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.686 2.258 . . . . 0.0 112.299 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 57.4 m -96.83 -6.92 34.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.858 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -73.0 -175.78 1.88 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.918 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 122' ' ' THR . . . . . 0.493 ' CG2' HG22 ' B' ' 155' ' ' THR . 5.2 p -135.07 164.34 27.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.189 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 123' ' ' ILE . . . . . 0.823 HG22 ' HE2' ' B' ' 127' ' ' LYS . 38.2 mm -54.27 -38.8 40.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.149 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -60.77 -35.78 77.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.907 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.03 -41.88 94.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.857 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . 0.776 HG22 HG11 ' B' ' 117' ' ' VAL . 23.9 t -56.74 -38.4 58.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.072 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 127' ' ' LYS . . . . . 0.823 ' HE2' HG22 ' B' ' 123' ' ' ILE . 25.0 mttm -78.21 -28.94 48.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.76 -51.67 68.0 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.15 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.681 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -72.19 -39.23 68.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.935 179.919 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . 0.446 ' CG1' HD12 ' B' ' 115' ' ' LEU . 55.9 mt -57.02 -29.58 31.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.146 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -56.39 -46.13 80.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.925 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -69.72 -11.69 61.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.81 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 133' ' ' LYS . . . . . 0.559 ' HD3' HD11 ' B' ' 115' ' ' LEU . 10.0 mptt -89.61 -66.26 0.94 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.898 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 134' ' ' GLU . . . . . 0.429 ' OE1' HD12 ' B' ' 136' ' ' ILE . 1.1 tm-20 -81.81 -45.49 15.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.898 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.69 37.34 1.74 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.533 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . 0.627 HD13 HD11 ' B' ' 171' ' ' LEU . 0.6 OUTLIER -129.37 142.22 44.49 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.631 0.729 . . . . 0.0 111.184 179.982 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 144.36 53.65 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.61 2.206 . . . . 0.0 112.35 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 138' ' ' PRO . . . . . 0.406 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.6 Cg_endo -69.77 -14.64 36.33 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.724 2.283 . . . . 0.0 112.312 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -81.57 -0.71 43.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.857 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -121.49 -37.59 2.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.961 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . 0.467 ' HB2' HD11 ' B' ' 169' ' ' LEU . 18.7 pt20 -85.43 155.02 21.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.913 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 45.5 mtt180 -139.06 -178.67 5.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.902 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . 0.804 HD12 HG23 ' B' ' 123' ' ' ILE . 13.2 mt -130.0 153.98 47.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.539 HD13 ' O ' ' B' ' 143' ' ' LEU . 22.0 mm -136.14 119.31 22.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.066 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 145' ' ' PHE . . . . . 0.819 ' HB3' HD11 ' B' ' 150' ' ' LEU . 5.1 t80 -153.48 146.38 24.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.874 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 65.45 28.81 11.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.132 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . 0.691 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 69.62 8.88 60.91 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.505 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.36 159.98 37.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.665 0.269 . . . . 0.0 110.926 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.87 128.44 34.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.87 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.819 HD11 ' HB3' ' B' ' 145' ' ' PHE . 5.1 mt -96.93 130.06 44.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.926 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -131.12 178.56 6.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.88 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.74 -16.86 59.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.918 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -55.28 -22.73 31.09 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.464 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 6.0 mtp85 -137.22 167.9 20.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.906 0.384 . . . . 0.0 110.821 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 155' ' ' THR . . . . . 0.493 HG22 ' CG2' ' B' ' 122' ' ' THR . 64.1 p -99.19 -179.6 4.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.157 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 156' ' ' LEU . . . . . 0.621 HD12 HG21 ' B' ' 161' ' ' ILE . 3.7 mm? -65.06 -44.61 88.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.907 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 11.0 p -67.46 -18.31 65.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.894 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -76.84 -30.92 56.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.915 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 159' ' ' TYR . . . . . 0.591 ' CG ' HD22 ' B' ' 150' ' ' LEU . 27.7 m-85 -100.74 15.97 26.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.937 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 13.2 t30 57.88 34.21 24.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.905 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 161' ' ' ILE . . . . . 0.621 HG21 HD12 ' B' ' 156' ' ' LEU . 28.1 mm -68.93 109.08 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.183 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 81.1 mm-40 -101.24 173.47 6.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.955 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -61.02 140.38 57.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.868 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 58.63 48.93 11.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.879 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 3.3 m -82.96 137.92 34.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.872 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.67 96.63 8.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.148 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.589 ' HB3' HD22 ' B' ' 143' ' ' LEU . 6.0 mt -107.63 172.12 7.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.878 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 168' ' ' HIS . . . . . 0.492 ' O ' HD23 ' B' ' 143' ' ' LEU . 35.5 m-70 -132.39 170.06 15.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.846 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . 0.812 HD23 HG11 ' B' ' 105' ' ' VAL . 0.2 OUTLIER -121.57 119.11 30.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.952 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 170' ' ' VAL . . . . . 0.997 HG13 ' HB2' ' A' ' 36' ' ' ALA . 23.6 t -125.36 114.81 41.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.119 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.627 HD11 HD13 ' B' ' 136' ' ' ILE . 0.2 OUTLIER -99.76 119.36 38.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.94 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -111.13 77.96 1.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.861 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 9.0 mt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.848 -179.956 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.438 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.835 0.35 . . . . 0.0 111.082 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.958 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -134.29 129.83 36.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.893 -179.923 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.45 4.45 52.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.9 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.5 m -154.53 126.63 7.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.934 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HA ' ' HD2' ' A' ' 12' ' ' PRO . 11.2 t -52.14 108.23 1.03 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.693 0.759 . . . . 0.0 110.903 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.43 ' HD2' ' HA ' ' A' ' 11' ' ' CYS . 53.0 Cg_endo -69.86 -0.73 7.42 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.623 2.215 . . . . 0.0 112.298 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -96.26 -54.04 3.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.868 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.9 p -114.39 22.23 13.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.916 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.5 tp60 41.46 68.18 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.866 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.1 tppt? -125.08 103.88 8.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.911 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -56.31 107.99 0.43 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.881 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.687 ' CE2' HG13 ' A' ' 27' ' ' VAL . 36.2 m-85 -63.22 153.08 35.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.823 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.48 150.45 34.25 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.59 0.71 . . . . 0.0 111.067 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 168.6 21.22 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.642 2.228 . . . . 0.0 112.352 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 39.73 40.47 0.67 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.86 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.422 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -84.16 -176.49 6.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.967 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.9 p -129.46 164.4 23.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.107 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -52.35 -31.44 33.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.865 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.8 tp -71.92 -33.83 68.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.858 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.88 -59.51 4.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.871 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.687 HG13 ' CE2' ' A' ' 18' ' ' PHE . 21.7 t -57.59 -37.09 56.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.229 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -71.76 -36.29 70.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.878 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.6 m -54.92 -54.02 48.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.872 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -72.54 -43.12 63.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.87 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.958 HD11 HD11 ' A' ' 8' ' ' LEU . 13.5 mt -51.91 -31.81 30.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.883 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.34 -38.81 65.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.11 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -74.27 -45.58 46.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -53.1 -52.19 59.43 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.512 1.132 . . . . 0.0 108.271 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.657 HD12 HD11 ' B' ' 144' ' ' ILE . 17.0 mt -52.52 -56.21 16.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.911 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.817 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -57.94 -22.19 47.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.074 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -102.98 8.9 38.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.871 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.6 m -116.7 167.07 11.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.879 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.8 m -124.35 -33.54 3.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.142 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -51.16 -56.1 14.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.843 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 t0 63.72 54.49 1.82 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.899 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 29.4 m -81.64 165.11 2.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.128 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 6.1 m -115.01 117.07 29.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.095 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 33.5 p90 . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.972 179.93 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.864 0.364 . . . . 0.0 110.863 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -167.99 122.25 0.95 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.91 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 101' ' ' MET . . . . . 0.486 ' HE2' HG23 ' B' ' 117' ' ' VAL . 5.6 ptt? -100.69 170.73 8.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.903 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -119.84 141.72 49.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.934 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 103' ' ' ILE . . . . . 0.651 HD13 HG21 ' B' ' 117' ' ' VAL . 42.1 pt -134.43 164.86 33.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.094 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -122.43 149.11 44.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.876 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 105' ' ' VAL . . . . . 0.583 HG21 HD11 ' B' ' 130' ' ' ILE . 61.6 t -136.84 117.6 17.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.137 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.22 155.49 17.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.83 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 107' ' ' THR . . . . . 0.553 HG22 HD22 ' B' ' 169' ' ' LEU . 61.8 p -112.86 170.06 8.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.143 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . 0.408 HD11 ' CB ' ' A' ' 36' ' ' ALA . 63.7 mt -64.83 -15.8 62.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.937 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 24.0 p -90.43 -12.55 37.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.091 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 104.22 -8.98 49.57 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.508 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 8.6 ttmm -51.75 142.39 14.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.912 0.387 . . . . 0.0 110.881 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 27.8 m -112.34 106.42 14.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.157 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 71.8 mt -100.68 141.79 16.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.207 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 31.6 m -129.25 122.62 30.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.187 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.613 HD21 ' HE2' ' B' ' 133' ' ' LYS . 12.8 mt -144.49 170.57 15.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.883 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -109.77 151.31 27.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.917 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.651 HG21 HD13 ' B' ' 103' ' ' ILE . 4.1 m -146.7 174.71 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.098 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -122.15 161.32 43.45 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.621 0.724 . . . . 0.0 110.873 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 -9.21 25.52 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.712 2.275 . . . . 0.0 112.315 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 13.0 m -103.5 -19.35 14.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.861 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -59.34 -174.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.876 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 122' ' ' THR . . . . . 0.907 HG22 HG22 ' B' ' 155' ' ' THR . 59.2 p -142.13 172.87 12.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.105 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 123' ' ' ILE . . . . . 1.058 HG23 HD12 ' B' ' 143' ' ' LEU . 28.1 mm -58.35 -35.52 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.167 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -74.7 -25.02 58.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.876 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -74.45 -50.37 18.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.868 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . 0.411 HG23 HD11 ' B' ' 103' ' ' ILE . 2.4 p -56.59 -33.39 39.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.096 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -77.69 -28.46 51.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.945 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.49 -52.57 64.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.098 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.41 ' HD3' ' HA ' ' B' ' 126' ' ' VAL . 0.0 OUTLIER -70.98 -30.69 67.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 179.967 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . 0.583 HD11 HG21 ' B' ' 105' ' ' VAL . 47.5 mt -63.63 -29.37 47.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.082 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -58.15 -42.69 86.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.88 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -69.73 -11.44 60.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.872 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 133' ' ' LYS . . . . . 0.613 ' HE2' HD21 ' B' ' 115' ' ' LEU . 2.1 mptp? -90.92 -65.7 0.99 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.872 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -82.12 -45.48 15.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.911 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.3 42.35 1.18 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.472 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . 0.711 HD13 HD11 ' B' ' 171' ' ' LEU . 0.5 OUTLIER -136.78 143.1 41.3 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.688 0.756 . . . . 0.0 111.101 -179.976 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 144.79 55.33 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.707 2.272 . . . . 0.0 112.342 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 138' ' ' PRO . . . . . 0.405 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.8 Cg_endo -69.78 -12.74 33.47 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.693 2.262 . . . . 0.0 112.365 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -83.53 -0.3 49.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.869 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -119.6 -39.42 2.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.966 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . 0.405 ' HG2' ' HA ' ' B' ' 138' ' ' PRO . 19.5 pt20 -80.29 147.74 31.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.927 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -121.74 -178.46 3.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.89 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . 1.058 HD12 HG23 ' B' ' 123' ' ' ILE . 12.1 mt -136.39 147.98 47.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.918 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.677 HD13 ' O ' ' B' ' 143' ' ' LEU . 17.2 mm -134.0 125.71 49.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.126 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 145' ' ' PHE . . . . . 0.738 ' HB2' HD11 ' B' ' 150' ' ' LEU . 4.9 t80 -155.81 143.3 19.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.887 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 59.1 26.37 15.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.128 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . 0.643 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 71.89 9.54 70.9 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.45 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.87 151.37 40.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.785 0.326 . . . . 0.0 110.877 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -82.92 109.96 17.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.959 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.738 HD11 ' HB2' ' B' ' 145' ' ' PHE . 4.5 mt -75.86 132.69 40.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.944 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -128.25 159.44 35.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.906 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -53.29 -26.7 19.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.886 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -52.05 -25.92 18.49 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.502 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -118.37 167.64 11.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.896 0.379 . . . . 0.0 110.925 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 155' ' ' THR . . . . . 0.907 HG22 HG22 ' B' ' 122' ' ' THR . 65.0 p -110.57 -179.4 3.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.13 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 156' ' ' LEU . . . . . 0.591 HD13 HD12 ' B' ' 161' ' ' ILE . 3.7 mm? -64.28 -41.1 97.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.942 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 38.2 t -67.25 -19.73 65.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.859 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -75.42 -35.88 60.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 159' ' ' TYR . . . . . 0.415 ' CG ' HD22 ' B' ' 150' ' ' LEU . 40.5 m-85 -100.47 8.44 43.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.958 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 10.2 t30 51.23 45.02 28.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.916 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 161' ' ' ILE . . . . . 0.591 HD12 HD13 ' B' ' 156' ' ' LEU . 87.9 mt -78.98 105.31 8.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.098 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 64.7 mm-40 -89.62 -169.59 2.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.957 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 29.4 tttt -70.26 155.9 40.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.92 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 51.98 52.23 14.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.894 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.4 p -91.29 132.63 36.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.92 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 5.5 m -87.04 84.49 7.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.118 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.616 ' HB3' HD22 ' B' ' 143' ' ' LEU . 6.1 mt -97.92 134.71 40.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 56.5 m-70 -99.14 143.26 29.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.862 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . 0.9 HD21 HD12 ' B' ' 171' ' ' LEU . 2.2 tt -103.61 140.85 37.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.89 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 170' ' ' VAL . . . . . 0.817 HG13 ' HB2' ' A' ' 36' ' ' ALA . 11.4 t -138.57 111.17 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.08 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.9 HD12 HD21 ' B' ' 169' ' ' LEU . 0.1 OUTLIER -86.95 119.6 27.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.919 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 12.6 tpp85 -111.64 77.37 1.04 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.831 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 8.0 mp . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.861 -179.991 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.423 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.871 0.367 . . . . 0.0 111.121 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.64 HD12 ' HE2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -138.17 145.81 41.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.93 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.56 -1.54 21.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.842 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -154.29 123.25 6.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.886 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.9 t -51.24 106.58 0.67 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.594 0.711 . . . . 0.0 110.873 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.7 -3.8 12.71 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.703 2.269 . . . . 0.0 112.375 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.0 mtt -89.03 -54.82 3.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.86 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.0 p -113.91 19.49 16.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.955 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 44.44 67.19 0.72 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.853 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 tppt? -124.02 111.71 16.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.816 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -64.76 120.75 13.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.896 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.64 ' HE2' HD12 ' A' ' 8' ' ' LEU . 39.8 m-85 -75.77 153.28 37.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.868 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.39 152.19 45.12 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.564 0.697 . . . . 0.0 111.074 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 170.3 16.82 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.678 2.252 . . . . 0.0 112.335 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.6 39.04 0.46 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.901 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.543 HD22 HG22 ' A' ' 27' ' ' VAL . 0.5 OUTLIER -83.47 -179.12 7.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.864 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -125.76 163.95 21.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.078 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -51.29 -37.15 45.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.909 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.455 ' O ' HD13 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -71.59 -40.06 70.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.922 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -53.6 -46.4 70.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.885 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.624 HG13 ' CE2' ' A' ' 18' ' ' PHE . 11.8 t -71.28 -55.84 12.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.113 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.512 ' HA ' HD22 ' A' ' 31' ' ' LEU . 37.1 m-20 -51.43 -32.67 27.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.817 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.3 m -54.53 -54.63 38.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.84 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -70.15 -35.25 73.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.925 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.634 HD21 HD11 ' A' ' 8' ' ' LEU . 0.4 OUTLIER -53.89 -44.47 70.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.907 179.974 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.51 -33.72 76.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.048 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -73.82 -53.1 11.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.935 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -53.49 -56.96 12.6 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.5 1.125 . . . . 0.0 108.327 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.751 ' HG ' HG11 ' B' ' 170' ' ' VAL . 24.8 tp -52.34 -48.79 65.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.998 -1.001 . . . . 0.0 110.909 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.652 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -62.09 -22.04 65.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.115 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -99.39 -2.52 36.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.896 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -112.05 157.13 21.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.856 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.0 p -107.83 4.22 25.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.159 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -110.44 103.94 12.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.91 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -80.0 62.88 4.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.801 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.5 p -77.93 145.28 10.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.106 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 33.0 m -99.74 111.0 23.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.143 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 38.3 p90 . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.895 -179.997 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 5.3 m . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.907 0.384 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -134.66 -81.09 0.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.906 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -172.13 155.83 3.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.847 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -109.18 147.41 32.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.989 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 103' ' ' ILE . . . . . 0.49 HD13 HG21 ' B' ' 117' ' ' VAL . 44.4 pt -139.76 155.24 24.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.099 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -120.24 141.4 49.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.891 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 105' ' ' VAL . . . . . 0.578 HG21 HD11 ' B' ' 130' ' ' ILE . 39.0 t -129.0 125.64 63.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.067 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.23 154.23 18.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.917 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 39.5 p -111.54 175.24 5.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.093 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . 0.524 HD11 ' CB ' ' A' ' 36' ' ' ALA . 12.8 mt -71.55 -12.94 61.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.878 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 49.1 p -90.43 -12.62 36.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.156 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 102.7 -15.12 56.03 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.501 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 19.0 ttmt -51.74 155.22 1.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.885 0.374 . . . . 0.0 110.848 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 54.9 m -118.83 107.48 13.67 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.095 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 63.7 mt -97.11 141.89 14.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.142 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 11.6 m -129.2 131.2 47.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.161 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.818 HD13 ' HG3' ' B' ' 129' ' ' LYS . 17.8 mt -150.13 170.43 18.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.915 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -109.78 148.58 31.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.897 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.574 HG11 HG22 ' B' ' 126' ' ' VAL . 23.8 m -148.65 169.22 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.128 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -113.09 157.65 40.21 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.711 0.767 . . . . 0.0 110.825 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -10.39 28.38 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.667 2.245 . . . . 0.0 112.372 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 14.8 m -107.33 -13.05 15.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.834 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -63.86 -175.21 0.13 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.875 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 122' ' ' THR . . . . . 0.475 HG22 HG22 ' B' ' 155' ' ' THR . 21.6 p -132.1 165.99 22.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.121 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 123' ' ' ILE . . . . . 0.875 HG23 HD12 ' B' ' 143' ' ' LEU . 37.9 mm -57.51 -41.06 78.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.113 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -57.56 -33.23 67.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.872 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.52 -42.44 74.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.864 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . 0.574 HG22 HG11 ' B' ' 117' ' ' VAL . 36.1 t -56.67 -35.52 45.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.147 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 127' ' ' LYS . . . . . 0.793 ' HE2' HG22 ' B' ' 123' ' ' ILE . 34.3 mttm -78.56 -28.7 45.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.909 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.56 -51.88 66.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.064 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.818 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -71.57 -39.88 70.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.942 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . 0.578 HD11 HG21 ' B' ' 105' ' ' VAL . 51.6 mt -53.68 -29.92 18.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.114 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -60.78 -41.49 95.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.925 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -68.81 -11.49 60.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.819 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 133' ' ' LYS . . . . . 0.525 ' HD3' HD21 ' B' ' 115' ' ' LEU . 0.1 OUTLIER -93.86 -66.12 0.94 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.905 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -80.5 -46.44 15.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.863 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.27 35.03 2.19 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.495 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . 0.776 HD13 HD11 ' B' ' 171' ' ' LEU . 0.7 OUTLIER -124.97 142.07 40.11 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.579 0.704 . . . . 0.0 111.107 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.86 144.59 53.98 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.619 2.213 . . . . 0.0 112.338 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 138' ' ' PRO . . . . . 0.401 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 54.1 Cg_endo -69.77 -13.06 34.11 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.705 2.27 . . . . 0.0 112.36 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -82.62 -1.45 51.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.896 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -122.25 -38.14 2.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.9 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . 0.564 ' OE1' HD21 ' B' ' 169' ' ' LEU . 12.5 pt20 -83.38 153.66 24.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.908 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 29.0 mtt-85 -137.03 179.56 6.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.852 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . 0.875 HD12 HG23 ' B' ' 123' ' ' ILE . 13.0 mt -128.04 152.4 47.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.855 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.555 HD13 ' O ' ' B' ' 143' ' ' LEU . 23.7 mm -138.61 111.14 6.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.095 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 145' ' ' PHE . . . . . 0.726 ' HB3' HD11 ' B' ' 150' ' ' LEU . 4.2 t80 -146.35 145.43 30.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.854 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 63.93 24.37 13.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.083 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 68.68 28.35 73.2 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.467 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -143.99 154.3 43.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.791 0.329 . . . . 0.0 110.905 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -84.46 109.7 18.1 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.857 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.726 HD11 ' HB3' ' B' ' 145' ' ' PHE . 3.8 mt -81.31 131.39 35.29 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.919 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -137.99 -179.66 5.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.95 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.02 -16.57 60.28 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.829 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -58.87 -19.01 42.14 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.512 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 14.1 mtp85 -140.31 167.79 21.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.859 0.361 . . . . 0.0 110.882 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 155' ' ' THR . . . . . 0.475 HG22 HG22 ' B' ' 122' ' ' THR . 41.4 p -101.2 -179.86 4.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.211 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 156' ' ' LEU . . . . . 0.64 HD12 HG21 ' B' ' 161' ' ' ILE . 3.7 mm? -64.06 -47.61 79.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.944 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 8.5 p -65.48 -16.29 63.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.842 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.44 -32.54 58.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.824 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 159' ' ' TYR . . . . . 0.714 ' CG ' HD22 ' B' ' 150' ' ' LEU . 33.0 m-85 -100.7 16.05 26.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.895 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 8.2 t30 59.08 34.97 23.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.898 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 161' ' ' ILE . . . . . 0.64 HG21 HD12 ' B' ' 156' ' ' LEU . 28.9 mm -68.61 104.22 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.151 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 65.8 mm-40 -96.42 175.63 6.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.895 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 38.1 tttt -60.5 141.82 56.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.883 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 63.99 35.95 10.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.858 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . 0.418 ' HB3' HD11 ' B' ' 167' ' ' LEU . 1.5 m -67.68 128.95 38.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.814 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 166' ' ' THR . . . . . 0.404 ' CG2' HD21 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -93.26 96.31 9.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.145 179.986 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.634 ' HB3' HD22 ' B' ' 143' ' ' LEU . 4.9 mp -106.76 166.76 10.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.949 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 168' ' ' HIS . . . . . 0.461 ' O ' HD23 ' B' ' 143' ' ' LEU . 91.2 m-70 -115.59 169.9 8.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.933 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . 0.598 HD13 ' N ' ' B' ' 170' ' ' VAL . 0.5 OUTLIER -123.28 129.66 51.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.919 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 170' ' ' VAL . . . . . 0.751 HG11 ' HG ' ' A' ' 35' ' ' LEU . 90.7 t -133.03 123.0 47.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.12 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.776 HD11 HD13 ' B' ' 136' ' ' ILE . 0.2 OUTLIER -106.66 118.46 36.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.922 179.926 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -111.23 77.73 1.06 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.851 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 14.4 mt . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.884 -179.944 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.566 ' HB3' ' O ' ' B' ' 146' ' ' ALA . . . . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 120.836 0.35 . . . . 0.0 111.134 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.497 HD21 ' HA3' ' B' ' 147' ' ' GLY . 0.1 OUTLIER -132.05 130.26 41.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.918 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -92.76 -2.46 55.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.841 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -154.41 127.28 8.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 32.4 t -51.85 107.59 0.87 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.609 0.719 . . . . 0.0 110.958 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -2.65 10.5 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.704 2.269 . . . . 0.0 112.327 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.67 -54.68 3.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.844 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.4 p -114.03 21.09 15.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.896 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 43.17 66.08 0.85 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.869 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.3 tppt? -122.51 106.69 11.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.894 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -59.29 120.72 9.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.933 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.633 ' CE2' HG13 ' A' ' 27' ' ' VAL . 37.8 m-85 -76.83 153.24 35.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.892 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.69 154.06 68.02 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.579 0.704 . . . . 0.0 111.065 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.85 167.8 23.51 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.691 2.261 . . . . 0.0 112.287 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 39.96 40.11 0.69 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.84 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.52 HD22 HG22 ' A' ' 27' ' ' VAL . 0.4 OUTLIER -81.0 -177.31 6.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.993 179.989 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.8 p -128.92 163.62 24.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.155 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.1 -36.77 51.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.927 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.773 HD13 HG21 ' B' ' 166' ' ' THR . 4.3 tp -71.65 -32.18 67.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.925 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -62.68 -48.67 78.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.81 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.633 HG13 ' CE2' ' A' ' 18' ' ' PHE . 21.4 t -75.06 -38.72 43.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.13 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -65.07 -41.5 95.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.843 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.2 m -51.7 -53.91 34.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.841 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -70.45 -42.05 72.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.834 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.481 HD23 ' O ' ' A' ' 27' ' ' VAL . 1.3 mm? -53.24 -33.54 53.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.898 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.69 -39.07 67.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.105 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -72.28 -48.89 39.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.08 -52.16 61.84 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.553 1.158 . . . . 0.0 108.33 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.602 ' CD2' HD11 ' B' ' 144' ' ' ILE . 23.6 tp -55.73 -45.85 77.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.9 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.06 -24.51 62.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.15 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -89.64 -34.69 16.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.898 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.2 t -96.99 113.01 24.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.936 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.0 t -63.52 -27.26 69.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.149 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -61.83 134.29 56.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.852 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -113.29 58.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.899 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 42' ' ' VAL . 17.0 m -82.39 119.66 32.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.09 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.83 131.03 35.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.138 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 29.5 p90 . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.871 179.966 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.943 0.401 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -124.1 -174.61 3.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.871 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 7.9 ptt? -100.01 173.79 6.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.918 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -118.15 157.18 27.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.915 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 103' ' ' ILE . . . . . 0.447 HD11 HG11 ' B' ' 117' ' ' VAL . 14.7 pt -145.06 166.47 11.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.075 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -124.45 152.97 42.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.885 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 105' ' ' VAL . . . . . 0.963 HG21 HD11 ' B' ' 130' ' ' ILE . 62.1 t -134.74 132.27 54.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.116 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -108.69 136.46 48.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.945 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 2.3 p -99.3 164.1 12.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.167 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.9 mp -66.79 -13.88 62.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.893 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . 0.466 HG23 ' H ' ' B' ' 111' ' ' LYS . 5.1 t -90.2 -3.6 57.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.118 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 97.29 -27.55 18.03 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.471 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 111' ' ' LYS . . . . . 0.466 ' H ' HG23 ' B' ' 109' ' ' THR . 40.1 ttpt -52.49 140.22 23.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.814 0.34 . . . . 0.0 110.883 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 83.8 m -110.07 141.71 42.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.044 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 64.4 mt -125.36 141.99 43.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.164 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 13.9 m -125.69 110.33 13.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.15 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.618 HD11 ' HD3' ' B' ' 133' ' ' LYS . 11.6 mt -129.12 168.93 15.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -103.86 146.29 28.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.872 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.531 HG11 HG12 ' B' ' 126' ' ' VAL . 34.5 m -146.74 157.83 10.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.216 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 118' ' ' GLU . . . . . 0.413 ' HB3' ' HD2' ' B' ' 119' ' ' PRO . 8.0 mt-10 -100.83 155.6 36.14 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.622 0.725 . . . . 0.0 110.851 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 119' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' B' ' 118' ' ' GLU . 52.8 Cg_endo -69.78 -8.31 23.27 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.71 2.273 . . . . 0.0 112.326 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 3.6 m -109.56 -10.43 14.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.824 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -64.46 -174.03 0.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.854 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 22.9 p -130.55 176.52 8.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.101 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 123' ' ' ILE . . . . . 0.821 HG22 ' HE2' ' B' ' 127' ' ' LYS . 39.5 mm -65.3 -50.89 70.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.159 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -57.51 -20.3 30.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.857 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.84 -51.24 23.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.944 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . 0.74 HG22 ' O ' ' B' ' 123' ' ' ILE . 3.5 m -56.44 -24.76 19.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.101 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 127' ' ' LYS . . . . . 0.821 ' HE2' HG22 ' B' ' 123' ' ' ILE . 40.9 mttm -79.86 -31.79 40.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.892 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.59 -51.32 69.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.171 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.558 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -72.17 -39.97 68.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.82 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . 0.963 HD11 HG21 ' B' ' 105' ' ' VAL . 37.3 mt -58.06 -30.25 38.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.082 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -57.31 -45.13 84.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.901 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -71.97 -11.37 60.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.915 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 133' ' ' LYS . . . . . 0.618 ' HD3' HD11 ' B' ' 115' ' ' LEU . 0.1 OUTLIER -85.46 -66.13 0.93 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.895 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -85.07 -42.23 15.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.879 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.48 42.2 1.17 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.524 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -132.07 142.28 44.52 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.611 0.72 . . . . 0.0 111.089 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 143.84 52.06 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.68 2.253 . . . . 0.0 112.362 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 138' ' ' PRO . . . . . 0.413 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.8 Cg_endo -69.75 -12.68 33.41 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.624 2.216 . . . . 0.0 112.352 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -83.19 -1.07 52.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.91 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -121.86 -37.86 2.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.969 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . 0.528 ' OE1' HD11 ' B' ' 169' ' ' LEU . 18.0 pt20 -84.04 145.61 28.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.959 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 26.5 mmt85 -129.6 178.42 6.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.82 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . 0.744 HD21 HD22 ' B' ' 167' ' ' LEU . 6.6 tp -121.51 151.68 40.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.935 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.602 HD11 ' CD2' ' A' ' 35' ' ' LEU . 30.8 mm -139.65 110.36 4.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.109 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 145' ' ' PHE . . . . . 0.771 ' CB ' HD11 ' B' ' 150' ' ' LEU . 48.1 t80 -138.22 141.95 39.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.884 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . 0.566 ' O ' ' HB3' ' A' ' 7' ' ' ALA . . . 63.67 24.53 13.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.098 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . 0.497 ' HA3' HD21 ' A' ' 8' ' ' LEU . . . 71.48 13.34 74.13 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.439 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -123.54 166.27 15.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.729 0.299 . . . . 0.0 110.933 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -92.25 123.7 35.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.921 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.771 HD11 ' CB ' ' B' ' 145' ' ' PHE . 2.2 mt -96.91 130.99 44.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.898 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -128.09 170.14 13.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.843 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -60.78 -19.22 58.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.843 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -56.47 -22.24 37.63 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.497 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 15.9 mtt-85 -128.36 166.65 18.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.896 0.379 . . . . 0.0 110.883 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 69.8 p -101.2 -179.71 4.12 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.122 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 156' ' ' LEU . . . . . 0.496 HD13 HD12 ' B' ' 161' ' ' ILE . 3.9 mm? -64.97 -47.88 76.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.017 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 34.1 t -66.03 -15.72 63.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.815 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.79 -32.67 62.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.834 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 159' ' ' TYR . . . . . 0.523 ' CG ' HD22 ' B' ' 150' ' ' LEU . 37.1 m-85 -100.7 16.11 26.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.884 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 9.4 t30 59.17 34.64 23.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.882 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 161' ' ' ILE . . . . . 0.514 HD11 HD13 ' B' ' 150' ' ' LEU . 77.9 mt -80.94 95.57 2.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.147 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -90.16 -169.5 2.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.982 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -62.55 150.09 41.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.88 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 51.18 55.83 8.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.895 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 2.3 m -89.86 132.47 35.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.873 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 166' ' ' THR . . . . . 0.773 HG21 HD13 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -92.49 94.35 9.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.087 -179.911 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.744 HD22 HD21 ' B' ' 143' ' ' LEU . 2.8 mp -112.82 142.2 45.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.949 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -97.62 169.96 9.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.841 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . 0.528 HD11 ' OE1' ' B' ' 141' ' ' GLN . 4.7 tp -120.9 143.04 49.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.878 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 170' ' ' VAL . . . . . 0.568 HG21 HD23 ' A' ' 35' ' ' LEU . 26.0 t -132.93 112.71 18.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.146 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.77 114.79 29.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 172' ' ' ARG . . . . . 0.565 ' HD3' HG12 ' B' ' 170' ' ' VAL . 0.5 OUTLIER -111.33 77.89 1.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.878 179.928 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.904 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.42 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.826 0.346 . . . . 0.0 111.117 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.84 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -133.09 133.38 42.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.919 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.66 2.04 49.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.917 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -154.26 125.55 7.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.818 -179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.6 t -51.98 108.02 0.97 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.679 0.752 . . . . 0.0 110.94 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -2.63 10.53 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.632 2.221 . . . . 0.0 112.346 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 15.6 mtm -93.08 -54.49 3.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.892 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.9 p -112.63 21.09 15.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.9 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 42.08 63.38 1.37 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.893 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -122.02 105.72 10.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.888 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -57.08 112.66 1.42 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.869 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.677 ' CE2' HG13 ' A' ' 27' ' ' VAL . 35.6 m-85 -66.27 153.56 42.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.861 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.91 152.74 47.75 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.564 0.697 . . . . 0.0 111.136 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 168.1 22.54 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.684 2.256 . . . . 0.0 112.325 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.57 40.69 0.65 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.817 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.502 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -82.41 -176.89 6.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.998 179.917 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.1 p -129.31 162.24 28.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.166 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 21.8 mm100 -51.09 -36.23 39.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.882 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.628 HD22 HG21 ' B' ' 166' ' ' THR . 17.0 tp -71.85 -34.27 69.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.916 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -60.09 -50.56 73.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.856 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.677 HG13 ' CE2' ' A' ' 18' ' ' PHE . 60.7 t -71.09 -30.27 40.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.134 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -71.21 -43.2 67.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.823 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.4 m -51.67 -53.98 33.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.893 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -68.26 -44.89 74.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.833 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.84 HD11 HD11 ' A' ' 8' ' ' LEU . 11.5 mt -52.47 -36.57 55.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.905 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.32 -41.68 96.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.125 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.548 HE21 HD21 ' B' ' 108' ' ' LEU . 1.8 mm-40 -74.06 -50.0 21.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.903 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.28 -42.23 69.79 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.473 1.108 . . . . 0.0 108.24 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.454 HD23 HG11 ' B' ' 170' ' ' VAL . 23.1 tp -64.66 -49.71 69.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.954 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.72 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -60.82 -23.1 64.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.066 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -93.71 -21.45 19.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.885 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.1 t -70.47 153.69 42.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.872 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -105.82 -17.68 14.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.192 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -114.18 132.75 55.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.887 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -88.97 70.34 8.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.884 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.7 m -81.84 127.09 39.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.159 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.1 m -90.32 118.25 29.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.18 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 33.4 p90 . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.887 -179.977 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 49.7 p . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.865 0.364 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -164.95 126.31 2.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.856 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 101' ' ' MET . . . . . 0.498 ' HE2' HG23 ' B' ' 117' ' ' VAL . 10.3 ptt? -106.51 172.45 6.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.938 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -127.76 159.68 34.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.924 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 41.5 pt -142.92 162.68 17.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.107 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -126.91 119.23 26.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.85 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 105' ' ' VAL . . . . . 0.68 HG11 HD23 ' B' ' 169' ' ' LEU . 21.9 t -108.31 118.52 56.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.137 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.08 126.54 43.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.898 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 79.0 p -64.42 173.68 1.99 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.145 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . 0.548 HD21 HE21 ' A' ' 33' ' ' GLN . 3.6 tp -79.95 -1.16 38.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.935 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.7 t -105.93 -12.9 15.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.142 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 120.55 -25.45 7.28 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.453 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -48.68 138.63 10.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.809 0.338 . . . . 0.0 110.916 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 90.6 m -108.77 119.63 40.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.215 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 113' ' ' ILE . . . . . 0.53 HD11 ' CG ' ' B' ' 134' ' ' GLU . 62.3 mt -109.11 142.41 21.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.111 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 19.8 m -128.0 125.74 39.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.135 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.641 HD21 ' CE ' ' B' ' 133' ' ' LYS . 13.2 mt -146.99 159.48 43.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -96.79 140.68 31.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.875 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.623 HG11 HG12 ' B' ' 126' ' ' VAL . 34.0 m -144.43 156.58 14.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.126 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -103.95 161.61 22.43 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.623 0.725 . . . . 0.0 110.903 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 -24.43 29.64 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.716 2.278 . . . . 0.0 112.353 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 56.9 p -90.28 -12.35 38.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.828 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.466 ' C ' HD23 ' B' ' 156' ' ' LEU . 71.5 m-20 -61.57 -174.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.899 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 122' ' ' THR . . . . . 0.795 HG22 HG22 ' B' ' 155' ' ' THR . 33.8 p -137.25 162.16 34.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.21 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 123' ' ' ILE . . . . . 0.455 ' O ' HG22 ' B' ' 126' ' ' VAL . 41.8 mm -55.07 -34.72 32.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.159 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -72.39 -20.49 61.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -75.93 -52.78 9.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.925 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . 0.623 HG12 HG11 ' B' ' 117' ' ' VAL . 3.8 m -56.8 -28.23 27.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.165 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 9.6 mmtt -78.6 -29.62 46.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.923 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.47 -51.78 68.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.046 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.621 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -70.77 -39.63 73.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.927 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . 0.537 HD11 HG21 ' B' ' 105' ' ' VAL . 40.9 mt -54.88 -31.3 24.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.163 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -57.44 -43.19 83.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.899 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -72.67 -12.39 61.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.868 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 133' ' ' LYS . . . . . 0.641 ' CE ' HD21 ' B' ' 115' ' ' LEU . 3.2 mptp? -88.14 -64.39 1.15 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.941 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 134' ' ' GLU . . . . . 0.53 ' CG ' HD11 ' B' ' 113' ' ' ILE . 0.3 OUTLIER -81.91 -44.83 16.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.899 179.922 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.32 39.65 1.48 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.459 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . 0.434 HG12 HD21 ' B' ' 171' ' ' LEU . 0.0 OUTLIER -135.29 147.75 63.45 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.613 0.72 . . . . 0.0 111.152 -179.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 143.03 49.75 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.667 2.245 . . . . 0.0 112.367 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.68 -9.98 27.49 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.725 2.284 . . . . 0.0 112.369 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -83.6 -0.19 49.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.863 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . 0.437 ' HG2' HD13 ' B' ' 173' ' ' LEU . 3.4 mt-30 -120.85 -39.29 2.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.869 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . 0.573 ' HB2' HD11 ' B' ' 169' ' ' LEU . 20.1 pt20 -83.67 147.94 27.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.9 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 82.8 mtt180 -138.82 172.12 13.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . 0.667 HD22 HD22 ' B' ' 167' ' ' LEU . 5.9 mt -114.06 153.58 29.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.887 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.604 HD13 ' O ' ' B' ' 143' ' ' LEU . 23.5 mm -137.45 103.25 2.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.179 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 145' ' ' PHE . . . . . 0.745 ' CB ' HD11 ' B' ' 150' ' ' LEU . 9.8 t80 -138.47 147.52 43.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.883 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' B' ' 145' ' ' PHE . . . 67.56 24.03 8.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.091 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . 0.611 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 70.64 8.39 63.24 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.458 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.69 163.75 16.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.762 0.315 . . . . 0.0 110.916 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -89.1 109.83 20.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.896 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.745 HD11 ' CB ' ' B' ' 145' ' ' PHE . 3.6 mt -77.63 129.65 35.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.864 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -138.04 172.74 12.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.906 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -60.02 -19.21 51.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.87 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -57.27 -21.38 39.85 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.458 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 11.5 mtp180 -131.43 167.75 18.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.926 0.393 . . . . 0.0 110.865 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 155' ' ' THR . . . . . 0.795 HG22 HG22 ' B' ' 122' ' ' THR . 39.8 p -101.66 179.92 4.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.174 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 156' ' ' LEU . . . . . 0.85 HD13 HD12 ' B' ' 161' ' ' ILE . 4.2 mm? -65.87 -48.09 72.71 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.9 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 43.0 t -64.83 -20.59 66.48 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.856 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.2 -31.25 68.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.808 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 159' ' ' TYR . . . . . 0.49 ' CG ' HD22 ' B' ' 150' ' ' LEU . 36.2 m-85 -100.78 13.54 34.6 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.882 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 160' ' ' ASN . . . . . 0.432 ' ND2' HE22 ' B' ' 162' ' ' GLN . 14.5 t30 50.81 44.58 27.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.878 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 161' ' ' ILE . . . . . 0.85 HD12 HD13 ' B' ' 156' ' ' LEU . 92.3 mt -83.03 111.15 18.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.167 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 162' ' ' GLN . . . . . 0.432 HE22 ' ND2' ' B' ' 160' ' ' ASN . 14.7 mp0 -93.79 -176.2 3.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.858 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 36.0 tttt -69.43 145.37 52.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.912 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 62.91 36.94 12.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.94 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 2.3 m -72.83 139.36 46.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.875 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 166' ' ' THR . . . . . 0.628 HG21 HD22 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -97.09 107.22 19.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.153 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.667 HD22 HD22 ' B' ' 143' ' ' LEU . 1.1 mp -126.5 172.85 9.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.91 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -121.59 169.6 10.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.863 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . 0.68 HD23 HG11 ' B' ' 105' ' ' VAL . 0.2 OUTLIER -116.05 127.89 55.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.897 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 170' ' ' VAL . . . . . 0.72 HG13 ' HB2' ' A' ' 36' ' ' ALA . 16.1 t -125.53 114.21 38.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.09 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.511 HD12 HD12 ' B' ' 169' ' ' LEU . 0.0 OUTLIER -101.46 119.47 38.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.91 179.919 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 -111.06 96.46 6.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.892 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 173' ' ' LEU . . . . . 0.459 HD22 ' H ' ' B' ' 173' ' ' LEU . 1.5 mm? . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.906 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 37.7 m . . . . . 0 C--O 1.233 0.189 0 CA-C-O 120.92 0.39 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -104.74 43.17 1.12 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.82 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 4.4 mtt -93.92 159.27 15.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.876 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 152.05 -128.63 2.58 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.545 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 63.88 44.9 4.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.816 0.341 . . . . 0.0 111.047 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.605 ' HB1' HG21 ' A' ' 27' ' ' VAL . . . -175.23 155.33 1.89 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.063 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.483 ' C ' HD23 ' A' ' 8' ' ' LEU . . . -84.55 -9.67 58.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.077 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 1.117 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -151.97 143.39 23.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.876 -179.95 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.1 ttp85 -102.1 -16.04 16.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.889 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -137.47 124.4 21.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.838 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.4 t -51.24 106.64 0.68 Allowed Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 121.581 0.705 . . . . 0.0 110.925 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.76 -3.92 12.98 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.611 2.207 . . . . 0.0 112.307 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -90.03 -55.1 3.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.829 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.3 p -112.13 19.53 17.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.871 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 42.93 63.06 1.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.945 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.3 ttpt -125.89 113.78 17.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.884 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -61.83 120.41 10.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.896 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.624 ' HE2' HD12 ' A' ' 8' ' ' LEU . 57.5 m-85 -71.39 153.66 42.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.841 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.91 151.01 66.53 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.555 0.693 . . . . 0.0 111.128 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 170.57 16.31 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.671 2.247 . . . . 0.0 112.4 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 40.67 37.84 0.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.901 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.435 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.6 OUTLIER -83.61 -175.98 6.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.964 -179.983 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.6 p -132.29 162.32 31.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.167 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.44 -30.65 20.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.891 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.6 HD13 HG21 ' B' ' 166' ' ' THR . 9.2 tp -72.11 -37.14 69.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.972 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.28 -59.89 4.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.837 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.684 HG11 ' HG ' ' A' ' 8' ' ' LEU . 22.7 t -54.6 -48.64 70.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.139 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 49.9 m-20 -60.25 -43.43 96.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.854 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.4 m -51.97 -47.56 64.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.848 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -75.43 -40.8 57.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 1.117 HD11 HD11 ' A' ' 8' ' ' LEU . 26.7 mt -57.78 -28.58 64.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.909 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.403 ' HA ' HG21 ' B' ' 170' ' ' VAL . . . -73.44 -51.09 18.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.092 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.736 ' HA ' HD21 ' B' ' 108' ' ' LEU . 3.1 pt20 -68.45 -32.28 72.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.921 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 t -71.82 -49.25 40.21 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.476 1.11 . . . . 0.0 108.318 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.76 HD22 HD11 ' B' ' 144' ' ' ILE . 5.9 tp -52.35 -47.13 66.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.934 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.964 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -58.88 -38.52 79.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.049 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -73.84 -34.35 64.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.91 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.8 p -63.98 162.72 13.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.895 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 68.5 p -107.51 -24.72 11.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.194 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -104.16 125.7 50.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.861 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -94.21 59.54 2.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.881 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 32.8 m -74.33 149.97 7.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.119 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 51.4 m -98.05 112.21 24.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.143 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 36.8 p90 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.899 179.996 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 96.0 p . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.929 0.395 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -122.88 125.66 45.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.864 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.633 ' HE2' HG23 ' B' ' 117' ' ' VAL . 7.0 ptt? -101.49 155.47 18.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.908 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -103.66 154.86 19.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.903 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' ILE . . . . . 0.604 HD11 HG13 ' B' ' 126' ' ' VAL . 42.0 pt -147.35 155.22 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.166 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -122.53 143.43 49.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.86 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' VAL . . . . . 0.427 HG22 ' HB2' ' B' ' 167' ' ' LEU . 42.5 t -138.06 113.82 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.112 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -99.29 147.38 25.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.92 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' THR . . . . . 0.45 HG22 ' CB ' ' B' ' 169' ' ' LEU . 60.8 p -100.07 179.11 4.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.132 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . 0.736 HD21 ' HA ' ' A' ' 33' ' ' GLN . 6.7 mp -73.2 -9.79 59.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.874 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 50.9 p -90.89 -12.59 35.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.106 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 106.56 -22.17 31.07 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.472 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' LYS . . . . . 0.419 ' NZ ' HD11 ' B' ' 113' ' ' ILE . 26.0 ttpp -51.8 141.87 16.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.856 0.36 . . . . 0.0 110.915 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 6.5 m -118.95 117.5 28.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.136 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' ILE . . . . . 0.423 HD13 HG23 ' B' ' 130' ' ' ILE . 51.2 mt -102.03 134.39 42.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.17 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 95.2 m -119.16 109.89 16.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.117 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.67 HD21 ' CE ' ' B' ' 133' ' ' LYS . 19.9 mt -133.66 170.11 16.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.895 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -110.88 148.45 32.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.794 HG11 HG22 ' B' ' 126' ' ' VAL . 19.6 m -145.57 161.52 12.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.132 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -104.56 160.9 24.48 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-O 121.709 0.766 . . . . 0.0 110.835 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 -23.21 30.89 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.635 2.223 . . . . 0.0 112.365 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 15.0 p -93.62 -10.05 35.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.843 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 -66.69 -175.82 0.43 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.884 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' THR . . . . . 0.789 HG22 HG22 ' B' ' 155' ' ' THR . 37.9 p -133.21 165.37 24.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.126 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . 0.835 HG23 HD12 ' B' ' 143' ' ' LEU . 31.6 mm -55.12 -48.45 76.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.17 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.97 -34.39 63.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.912 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -43.75 94.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.875 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . 0.794 HG22 HG11 ' B' ' 117' ' ' VAL . 41.0 t -56.95 -32.61 39.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.146 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' LYS . . . . . 0.795 ' HE3' HG22 ' B' ' 123' ' ' ILE . 26.2 mttt -78.95 -28.87 43.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.89 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.59 -51.6 68.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.082 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.626 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -72.06 -37.31 69.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.933 179.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . 0.532 ' CG1' HD12 ' B' ' 115' ' ' LEU . 66.4 mt -61.22 -28.87 44.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.124 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -58.59 -43.49 89.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.921 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -70.98 -11.5 61.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.81 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . 0.67 ' CE ' HD21 ' B' ' 115' ' ' LEU . 4.4 mptp? -88.99 -66.41 0.92 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.933 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -81.85 -44.32 17.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.883 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.29 35.53 2.1 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.447 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . 0.71 HD13 HD11 ' B' ' 171' ' ' LEU . 0.9 OUTLIER -125.0 141.54 38.7 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.652 0.739 . . . . 0.0 111.1 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 143.53 50.98 Favored 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.652 2.235 . . . . 0.0 112.41 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 138' ' ' PRO . . . . . 0.411 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.7 Cg_endo -69.76 -12.81 33.67 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.714 2.276 . . . . 0.0 112.325 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -83.13 -1.59 53.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.84 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -122.09 -38.18 2.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.961 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . 0.563 ' HB2' HD11 ' B' ' 169' ' ' LEU . 15.3 pt20 -83.78 148.23 27.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.96 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 20.5 mmm-85 -132.44 176.82 8.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.874 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . 0.835 HD12 HG23 ' B' ' 123' ' ' ILE . 17.5 mt -125.36 147.79 49.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.896 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.76 HD11 HD22 ' A' ' 35' ' ' LEU . 23.2 mm -134.94 122.2 36.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.097 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 145' ' ' PHE . . . . . 0.765 ' HB3' HD11 ' B' ' 150' ' ' LEU . 53.0 t80 -157.76 144.48 17.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.894 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 62.86 27.97 16.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.072 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . 0.502 ' HA3' HD21 ' A' ' 8' ' ' LEU . . . 62.88 28.75 72.38 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.514 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -136.53 151.98 50.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.797 0.332 . . . . 0.0 110.914 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -81.8 109.54 16.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.87 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.765 HD11 ' HB3' ' B' ' 145' ' ' PHE . 3.8 mt -83.0 124.41 30.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.931 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -141.38 178.14 7.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.74 -19.06 58.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.928 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -58.08 -20.15 41.19 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.471 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 10.7 mtt180 -137.72 167.74 21.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.923 0.392 . . . . 0.0 110.851 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 155' ' ' THR . . . . . 0.789 HG22 HG22 ' B' ' 122' ' ' THR . 64.3 p -103.97 179.95 4.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.182 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . 0.542 HD13 HD12 ' B' ' 161' ' ' ILE . 4.3 mm? -63.01 -47.78 81.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.915 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 40.5 t -62.17 -18.85 62.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.869 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -70.63 -36.57 73.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.926 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 159' ' ' TYR . . . . . 0.54 ' CG ' HD22 ' B' ' 150' ' ' LEU . 62.4 m-85 -100.61 15.73 27.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.902 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 9.3 t30 52.42 36.19 19.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.817 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 161' ' ' ILE . . . . . 0.596 HD11 HD13 ' B' ' 150' ' ' LEU . 96.8 mt -75.43 101.92 2.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.081 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -91.55 -170.91 2.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.973 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 23.3 tttm -67.83 142.72 56.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.875 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 63.28 54.06 2.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 14.4 m -92.3 135.2 34.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.848 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 166' ' ' THR . . . . . 0.6 HG21 HD13 ' A' ' 25' ' ' LEU . 0.3 OUTLIER -90.07 93.45 9.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.165 -179.945 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.44 HD23 HD12 ' B' ' 150' ' ' LEU . 5.0 mp -106.38 159.54 16.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.92 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 5.1 m80 -112.87 169.59 8.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.848 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . 0.563 HD11 ' HB2' ' B' ' 141' ' ' GLN . 0.3 OUTLIER -121.35 128.89 52.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.967 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 170' ' ' VAL . . . . . 0.964 HG13 ' HB2' ' A' ' 36' ' ' ALA . 45.9 t -133.05 121.06 42.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.09 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.71 HD11 HD13 ' B' ' 136' ' ' ILE . 0.3 OUTLIER -105.71 119.29 38.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.962 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 19.8 mmm-85 -111.16 77.86 1.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.855 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 6.7 mt -51.67 141.36 16.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.944 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -91.24 -60.93 1.77 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.859 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -89.62 -30.52 13.26 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.546 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.531 -179.951 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.9 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.909 0.385 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 29.3 p80 -155.71 154.73 31.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.9 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.4 ttt -79.47 114.94 18.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.867 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.88 45.49 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.473 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -127.61 54.46 1.68 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.763 0.316 . . . . 0.0 111.106 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -171.69 164.11 6.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.043 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.512 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . -90.7 -25.24 20.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.086 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.822 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -143.28 139.05 29.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.935 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.78 8.54 28.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.855 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -155.32 124.2 6.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.898 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.423 ' HA ' ' HD2' ' A' ' 12' ' ' PRO . 22.2 t -51.8 107.75 0.9 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.573 0.701 . . . . 0.0 110.853 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 11' ' ' CYS . 53.4 Cg_endo -69.77 -1.1 7.9 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.652 2.235 . . . . 0.0 112.356 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -94.63 -54.3 3.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.869 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.6 p -114.78 21.58 14.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.903 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 42.55 69.09 0.41 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.97 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -125.85 105.42 8.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.937 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -57.17 112.02 1.24 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.859 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.684 ' CE2' HG13 ' A' ' 27' ' ' VAL . 31.0 m-85 -67.47 153.29 44.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.949 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.08 151.52 34.33 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.546 0.689 . . . . 0.0 111.119 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.64 168.7 20.63 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.739 2.293 . . . . 0.0 112.386 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.4 ptt-85 39.7 40.34 0.65 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.863 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.471 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -83.79 -176.27 6.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.923 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.9 p -128.63 163.59 24.72 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.1 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -53.01 -31.77 42.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.87 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 13.4 tp -71.9 -32.01 66.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.942 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.24 -60.4 3.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.854 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.684 HG13 ' CE2' ' A' ' 18' ' ' PHE . 67.2 t -54.76 -37.81 41.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.119 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.464 ' OD1' HG22 ' B' ' 144' ' ' ILE . 85.6 m-20 -72.14 -38.99 69.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.862 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.6 m -51.39 -53.98 31.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.85 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -71.55 -43.66 65.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.898 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.822 HD11 HD11 ' A' ' 8' ' ' LEU . 13.3 mt -52.39 -29.63 25.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.918 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.05 -41.77 63.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.139 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -74.14 -40.48 62.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.978 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.1 t -57.83 -41.44 82.29 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.471 1.107 . . . . 0.0 108.323 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.614 HD12 HD11 ' B' ' 144' ' ' ILE . 14.3 mt -64.91 -58.82 5.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.89 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.745 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -58.03 -22.14 48.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.091 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -90.07 -24.18 21.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.862 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 t -102.07 165.0 11.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.848 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.7 t -124.92 1.25 8.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.073 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -71.1 -42.44 69.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.879 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.6 t0 61.08 53.97 3.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.914 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 16.7 t -77.4 151.87 5.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.147 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 55.4 m -123.49 118.5 27.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.112 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 40.8 p90 . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.973 179.899 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 68.7 m . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.925 0.393 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -126.16 122.91 37.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.87 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.5 ptt? -106.4 168.49 9.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.875 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -120.29 156.84 30.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.921 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' ILE . . . . . 0.595 HG22 ' HB3' ' B' ' 165' ' ' SER . 24.6 pt -146.39 155.21 12.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.132 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -119.44 117.47 28.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.94 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' VAL . . . . . 0.625 HG21 HD11 ' B' ' 130' ' ' ILE . 66.9 t -106.42 122.06 59.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.092 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 2.3 ttmm -99.26 146.91 25.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.953 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 37.5 p -93.12 164.52 13.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.159 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 6.4 tp -61.94 -17.64 57.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.913 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.6 p -90.35 -12.72 36.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.15 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 109.65 -13.08 32.71 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.427 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 43.1 tttm -51.64 138.4 23.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.844 0.354 . . . . 0.0 110.865 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 24.8 m -105.35 124.3 49.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.146 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 72.5 mt -119.38 139.9 45.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.156 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 5.4 m -123.0 128.96 50.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.095 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.709 HD13 ' HG3' ' B' ' 129' ' ' LYS . 15.4 mt -149.78 170.33 18.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.856 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -108.38 151.91 25.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.896 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.698 HG11 HG22 ' B' ' 126' ' ' VAL . 6.4 m -148.62 175.06 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.076 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -125.6 160.99 53.21 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.706 0.765 . . . . 0.0 110.831 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 -26.57 27.3 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.678 2.252 . . . . 0.0 112.365 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.6 p -89.41 -15.89 32.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.861 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -63.51 -176.23 0.15 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.868 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 122' ' ' THR . . . . . 0.558 HG22 HG22 ' B' ' 155' ' ' THR . 17.4 p -133.41 170.95 14.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.185 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . 0.772 HG23 HD12 ' B' ' 143' ' ' LEU . 36.5 mm -60.5 -37.37 74.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.15 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -63.21 -33.16 74.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.911 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.88 -44.27 81.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.853 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . 0.698 HG22 HG11 ' B' ' 117' ' ' VAL . 41.9 t -56.34 -36.95 48.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.143 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -78.58 -28.36 45.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.933 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.75 -51.67 67.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.097 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.709 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -71.89 -37.39 70.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.955 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . 0.625 HD11 HG21 ' B' ' 105' ' ' VAL . 62.0 mt -59.31 -28.85 40.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.076 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -58.38 -43.74 88.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.89 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -70.23 -11.93 61.24 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.866 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . 0.605 ' CE ' HD21 ' B' ' 115' ' ' LEU . 4.9 mptp? -89.84 -66.07 0.96 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.869 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -80.7 -45.59 16.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.869 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.2 38.62 1.63 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.466 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . 0.935 HD13 HD11 ' B' ' 171' ' ' LEU . 0.4 OUTLIER -130.91 143.62 50.15 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.633 0.73 . . . . 0.0 111.12 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 142.93 49.2 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.715 2.276 . . . . 0.0 112.324 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 138' ' ' PRO . . . . . 0.41 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.7 Cg_endo -69.79 -12.35 32.66 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.686 2.258 . . . . 0.0 112.295 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -83.65 -0.75 51.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.83 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -121.88 -40.23 2.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.944 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . 0.493 ' HB2' HD11 ' B' ' 169' ' ' LEU . 15.9 pt20 -79.65 141.74 36.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.878 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -120.35 175.66 5.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.888 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . 0.772 HD12 HG23 ' B' ' 123' ' ' ILE . 12.3 mt -129.22 147.58 51.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.921 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.63 HD13 ' O ' ' B' ' 143' ' ' LEU . 17.6 mm -133.4 109.04 13.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.18 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 145' ' ' PHE . . . . . 0.753 ' CB ' HD11 ' B' ' 150' ' ' LEU . 28.5 t80 -143.01 145.63 33.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.943 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 63.93 25.11 13.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.084 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . 0.582 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 69.58 11.25 65.08 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.497 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 1.8 mtmt -125.61 152.02 45.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.694 0.283 . . . . 0.0 110.917 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -80.3 109.7 15.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.869 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.753 HD11 ' CB ' ' B' ' 145' ' ' PHE . 3.8 mt -76.12 141.87 41.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.891 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -147.81 170.61 17.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.909 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -60.83 -18.86 58.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.839 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.19 -17.38 45.37 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.535 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 15.3 mtt180 -133.62 167.58 20.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.911 0.386 . . . . 0.0 110.874 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 155' ' ' THR . . . . . 0.558 HG22 HG22 ' B' ' 122' ' ' THR . 71.7 p -104.2 -179.91 4.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.119 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . 0.791 HD13 HD12 ' B' ' 161' ' ' ILE . 4.5 mm? -65.62 -47.64 74.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 76.1 p -63.0 -23.86 67.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.886 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -68.72 -31.94 71.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.852 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 159' ' ' TYR . . . . . 0.455 ' CG ' HD22 ' B' ' 150' ' ' LEU . 38.9 m-85 -100.62 15.3 28.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.914 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 5.1 t30 51.14 32.11 7.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.895 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 161' ' ' ILE . . . . . 0.791 HD12 HD13 ' B' ' 156' ' ' LEU . 83.0 mt -72.76 103.82 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.085 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 67.5 mm-40 -93.47 -169.73 2.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.94 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 22.1 tttt -66.21 144.99 56.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 63.43 50.02 3.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . 0.595 ' HB3' HG22 ' B' ' 103' ' ' ILE . 1.5 t -87.27 122.49 31.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.896 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 1.4 m -90.68 113.81 25.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.124 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.71 HD23 ' HB2' ' B' ' 145' ' ' PHE . 0.4 OUTLIER -128.3 163.94 23.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.919 179.952 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -107.95 170.02 8.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.875 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . 0.552 ' CD1' HD12 ' B' ' 171' ' ' LEU . 0.6 OUTLIER -121.56 121.33 37.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.896 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 170' ' ' VAL . . . . . 0.745 HG13 ' HB2' ' A' ' 36' ' ' ALA . 17.6 t -124.11 109.93 24.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.07 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.935 HD11 HD13 ' B' ' 136' ' ' ILE . 0.1 OUTLIER -88.44 125.97 34.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.867 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 4.7 mtp180 -111.08 84.94 2.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.904 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 5.3 mt -67.46 -22.81 65.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.954 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 63.61 39.33 8.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.898 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 167.77 -99.83 0.16 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.529 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.434 -179.982 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.867 0.365 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 61.0 m170 -112.49 171.45 7.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.848 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -157.72 163.2 38.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.838 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 110.63 45.19 0.92 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.521 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -108.97 31.95 5.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.802 0.334 . . . . 0.0 111.108 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -159.09 -175.25 5.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.151 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.485 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . -88.98 -23.47 22.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.089 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.953 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -141.94 150.11 41.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.846 -179.965 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.36 -10.12 16.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.906 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -146.19 127.56 14.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.898 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.4 t -51.16 106.67 0.68 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.577 0.704 . . . . 0.0 110.9 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 -2.22 9.74 Favored 'Trans proline' 0 N--CA 1.465 -0.196 0 C-N-CA 122.745 2.297 . . . . 0.0 112.431 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 5.9 mtm -93.42 -54.86 3.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.877 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 15.2 p -114.06 22.38 13.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.901 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 41.58 70.31 0.28 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.902 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.0 tppt? -128.08 106.7 9.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.833 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -60.7 115.13 3.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.897 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.636 ' HE2' HD12 ' A' ' 8' ' ' LEU . 54.1 m-85 -70.99 153.8 42.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.847 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.59 151.97 68.61 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.596 0.712 . . . . 0.0 111.068 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.85 171.86 13.78 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.599 2.199 . . . . 0.0 112.286 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.79 37.87 0.39 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.893 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.435 ' C ' HD12 ' A' ' 22' ' ' LEU . 0.6 OUTLIER -83.99 -175.86 6.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.972 179.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 80.8 p -131.27 163.89 26.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.18 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -50.85 -31.84 18.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.863 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 1.014 HD12 HG21 ' B' ' 166' ' ' THR . 10.1 tt -72.18 -38.86 69.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.883 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -57.77 -46.69 84.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.861 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.568 HG11 ' HG ' ' A' ' 8' ' ' LEU . 18.7 t -72.05 -54.62 16.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.091 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -52.99 -43.01 66.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.87 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.6 m -51.38 -49.19 62.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.829 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -73.66 -45.95 49.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.802 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.953 HD11 HD11 ' A' ' 8' ' ' LEU . 62.4 mt -54.27 -25.67 24.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.922 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.41 -51.33 17.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.117 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -70.52 -31.57 68.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.928 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 t -73.28 -35.35 66.13 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.512 1.133 . . . . 0.0 108.263 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.811 HD22 HD11 ' B' ' 144' ' ' ILE . 45.7 tp -62.14 -52.07 65.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.874 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.822 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -55.78 -36.35 67.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.064 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -82.88 -16.07 48.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.864 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.3 p -67.51 136.38 54.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.867 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 51.9 m -63.11 -52.67 61.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.2 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -117.16 129.29 55.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.953 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -74.46 74.3 1.92 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.878 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.2 p -76.64 151.76 5.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.136 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.2 m -99.68 110.87 23.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.149 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 39.2 p90 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.859 -179.972 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 4.6 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.984 0.421 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -88.64 116.09 26.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.946 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 10.9 ptt? -91.73 167.84 11.89 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.868 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -121.26 136.91 54.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.968 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' ILE . . . . . 0.441 HD13 HG21 ' B' ' 117' ' ' VAL . 46.9 pt -124.85 155.18 33.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.126 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -116.03 115.92 26.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.838 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' VAL . . . . . 0.753 HG21 HD11 ' B' ' 130' ' ' ILE . 98.8 t -96.94 110.34 24.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.101 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -99.29 112.14 24.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.881 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 15.5 p -64.24 169.41 4.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.217 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 27.6 tp -73.61 -8.09 54.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.885 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 30.7 p -93.9 -12.8 28.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.179 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 111.65 -15.64 26.67 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.447 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 19.2 tptt -51.49 139.86 19.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.78 0.324 . . . . 0.0 110.981 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 12.5 m -113.19 104.07 11.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.207 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' ILE . . . . . 0.638 ' CD1' HG23 ' B' ' 130' ' ' ILE . 15.0 mt -100.04 141.78 16.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.151 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 25.9 m -120.34 107.98 13.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.106 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.724 HD13 ' HB2' ' B' ' 129' ' ' LYS . 38.1 mt -124.43 171.64 9.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.906 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -120.51 128.76 53.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.722 HG11 HG22 ' B' ' 126' ' ' VAL . 17.2 m -127.64 -179.61 2.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.101 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -131.01 161.18 63.19 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.614 0.721 . . . . 0.0 110.917 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 -10.73 29.29 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.699 2.266 . . . . 0.0 112.328 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 2.1 p -104.33 -22.01 13.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.871 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -59.17 -175.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.854 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 122' ' ' THR . . . . . 0.648 HG22 HG22 ' B' ' 155' ' ' THR . 22.1 p -133.31 163.04 30.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.155 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . 1.016 HG23 HD12 ' B' ' 143' ' ' LEU . 37.8 mm -56.18 -44.15 78.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.14 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -52.69 -33.89 49.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.841 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.9 -44.41 80.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.962 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . 0.722 HG22 HG11 ' B' ' 117' ' ' VAL . 21.5 t -60.6 -27.87 41.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.147 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 127' ' ' LYS . . . . . 0.585 ' HE3' HG22 ' B' ' 123' ' ' ILE . 93.4 mttt -78.97 -29.47 43.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.891 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -71.38 -30.79 66.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.172 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.724 ' HB2' HD13 ' B' ' 115' ' ' LEU . 0.3 OUTLIER -77.5 -49.32 15.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.858 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . 0.753 HD11 HG21 ' B' ' 105' ' ' VAL . 31.8 mt -53.87 -31.04 20.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.154 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -59.23 -36.83 76.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.887 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.84 -12.47 60.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.83 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . 0.418 ' HD3' HD21 ' B' ' 115' ' ' LEU . 2.8 mptp? -96.71 -65.86 0.94 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.924 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 134' ' ' GLU . . . . . 0.62 ' CG ' HD11 ' B' ' 113' ' ' ILE . 0.9 OUTLIER -75.96 -45.31 35.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.908 179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.21 19.97 7.74 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.453 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -110.27 144.08 29.38 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.579 0.704 . . . . 0.0 111.124 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 144.27 53.41 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.655 2.237 . . . . 0.0 112.345 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 138' ' ' PRO . . . . . 0.405 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.5 Cg_endo -69.81 -12.87 33.67 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.638 2.225 . . . . 0.0 112.283 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -82.79 -1.38 51.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.909 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -122.18 -37.72 2.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . 0.628 ' OE1' HD11 ' B' ' 169' ' ' LEU . 17.7 pt20 -84.95 140.94 30.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.912 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 15.1 mmt85 -122.81 179.88 4.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . 1.016 HD12 HG23 ' B' ' 123' ' ' ILE . 11.7 mt -127.51 146.19 50.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.905 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.811 HD11 HD22 ' A' ' 35' ' ' LEU . 24.7 mm -136.9 129.94 45.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.141 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 145' ' ' PHE . . . . . 0.809 ' HB3' HD11 ' B' ' 150' ' ' LEU . 43.0 t80 -169.24 146.16 3.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.878 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 64.79 24.29 12.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.115 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . 0.481 ' HA3' HD21 ' A' ' 8' ' ' LEU . . . 65.67 28.8 73.97 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.472 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -141.57 154.37 45.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.742 0.306 . . . . 0.0 110.917 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -81.95 109.51 16.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.945 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.809 HD11 ' HB3' ' B' ' 145' ' ' PHE . 3.6 mt -80.67 125.34 29.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.885 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -139.32 178.84 6.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.9 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.19 -16.55 60.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.818 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.96 -16.88 49.49 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.482 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 16.9 mtt180 -139.71 167.76 21.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.942 0.401 . . . . 0.0 110.808 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 155' ' ' THR . . . . . 0.648 HG22 HG22 ' B' ' 122' ' ' THR . 24.2 p -103.77 179.93 4.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.116 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . 0.67 HD13 HD12 ' B' ' 161' ' ' ILE . 4.4 mm? -63.46 -47.88 80.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.95 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 77.8 p -62.96 -17.03 61.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.948 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -71.84 -35.89 70.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.846 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 159' ' ' TYR . . . . . 0.548 ' CG ' HD22 ' B' ' 150' ' ' LEU . 68.8 m-85 -100.62 14.93 29.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.936 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 21.5 t30 51.2 41.74 28.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.938 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 161' ' ' ILE . . . . . 0.67 HD12 HD13 ' B' ' 156' ' ' LEU . 92.2 mt -80.87 104.99 10.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.131 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -93.92 -175.01 3.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.939 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 6.6 tttt -60.56 152.37 26.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.967 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 52.08 53.01 13.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.6 m -93.34 129.16 39.56 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.85 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 166' ' ' THR . . . . . 1.014 HG21 HD12 ' A' ' 25' ' ' LEU . 3.2 m -79.08 84.93 5.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.129 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.725 HD23 ' HB2' ' B' ' 145' ' ' PHE . 7.5 mt -96.98 124.96 41.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.879 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 14.2 m80 -89.57 168.43 12.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.898 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . 0.628 HD11 ' OE1' ' B' ' 141' ' ' GLN . 1.5 tp -126.14 143.19 51.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.878 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 170' ' ' VAL . . . . . 0.822 HG13 ' HB2' ' A' ' 36' ' ' ALA . 43.8 t -134.68 119.45 28.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.119 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.58 113.25 26.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.862 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 13.8 ttt-85 -111.31 77.85 1.07 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.811 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 2.0 mp -51.83 142.69 14.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.899 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 19.3 mmt180 -72.26 170.99 12.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.853 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -79.29 66.22 3.49 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.485 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.545 -179.976 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.0 p . . . . . 0 C--O 1.233 0.208 0 CA-C-O 120.789 0.328 . . . . 0.0 110.839 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -93.95 112.2 24.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.834 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 36.4 mtm -102.75 156.24 17.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.875 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -127.12 -102.35 1.2 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.524 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.03 111.41 3.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.8 0.333 . . . . 0.0 111.12 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -172.53 -176.03 1.46 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.091 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.541 ' C ' HD23 ' A' ' 8' ' ' LEU . . . -137.67 -44.87 0.54 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.135 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.614 HD21 ' O ' ' B' ' 147' ' ' GLY . 0.3 OUTLIER -125.29 164.58 20.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.907 -179.928 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.3 -17.42 10.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.904 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 2.0 m -152.61 127.78 9.79 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.847 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HA ' ' HD2' ' A' ' 12' ' ' PRO . 15.5 t -51.89 107.99 0.96 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.56 0.695 . . . . 0.0 110.892 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.416 ' HD2' ' HA ' ' A' ' 11' ' ' CYS . 53.4 Cg_endo -69.82 -2.87 10.94 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.605 2.203 . . . . 0.0 112.383 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtm -91.64 -54.32 3.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.931 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.8 p -113.29 20.39 16.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.928 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.08 61.13 2.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.915 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.8 ttpt -121.67 107.22 12.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -54.33 118.42 4.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.863 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.447 ' HB3' HD23 ' A' ' 22' ' ' LEU . 41.7 m-85 -70.19 152.6 44.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.891 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.71 148.8 74.25 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.535 0.683 . . . . 0.0 111.088 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 168.96 20.05 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.649 2.233 . . . . 0.0 112.368 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.3 ptt180 39.59 40.5 0.63 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.925 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.447 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -84.72 -176.5 6.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.85 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.45 161.8 28.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.122 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -50.5 -36.27 33.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.8 tt -72.13 -38.95 69.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.911 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 83.2 m-20 -52.97 -50.74 63.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.868 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.429 HG12 ' CD2' ' A' ' 31' ' ' LEU . 19.4 t -66.25 -53.58 35.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.148 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -50.99 -32.77 22.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.873 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.5 m -59.45 -54.93 40.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.859 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -71.42 -34.73 70.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.429 ' CD2' HG12 ' A' ' 27' ' ' VAL . 1.1 mp -53.09 -47.1 68.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.867 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.466 ' HA ' HG21 ' B' ' 170' ' ' VAL . . . -68.24 -33.41 74.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.09 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -73.79 -31.65 63.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.936 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -76.25 -54.63 6.51 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.489 1.118 . . . . 0.0 108.301 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.778 HD22 HG11 ' B' ' 170' ' ' VAL . 5.2 tt -51.26 -57.67 8.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.888 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.895 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -55.46 -32.2 62.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.139 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -78.19 -21.78 49.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 92.5 p -93.92 175.23 6.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.877 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.9 m -124.86 4.37 8.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.186 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -101.32 151.3 22.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.847 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -105.31 57.3 0.68 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.854 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 10.2 p -77.16 149.93 6.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.091 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.9 m -117.0 114.22 23.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.131 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.442 ' HH2' HD12 ' A' ' 35' ' ' LEU . 36.8 p90 . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.96 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 46.4 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.915 0.388 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -133.94 126.16 29.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.851 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.6 ptt? -107.57 170.38 8.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.903 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -123.66 139.64 53.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.925 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' ILE . . . . . 0.45 HG12 HG22 ' B' ' 117' ' ' VAL . 29.0 pt -127.97 170.68 17.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.116 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . 0.6 ' CE2' HG23 ' B' ' 114' ' ' THR . 47.9 m-85 -128.91 138.59 52.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.844 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' VAL . . . . . 0.852 HG21 HD11 ' B' ' 130' ' ' ILE . 58.1 t -118.52 111.54 34.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.093 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.52 117.15 33.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.882 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' THR . . . . . 0.593 ' OG1' HG22 ' B' ' 109' ' ' THR . 11.1 p -73.15 172.72 10.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.13 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 15.2 mt -79.46 -1.61 38.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.967 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . 0.593 HG22 ' OG1' ' B' ' 107' ' ' THR . 14.6 t -90.12 -12.49 38.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.108 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 100.34 14.99 31.34 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.549 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -97.11 145.44 26.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.871 0.367 . . . . 0.0 110.96 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 2.6 m -109.44 137.0 47.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.227 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 62.7 mt -127.53 142.28 44.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.136 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' THR . . . . . 0.6 HG23 ' CE2' ' B' ' 104' ' ' PHE . 1.3 m -119.76 130.86 55.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.115 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.501 HD13 ' HB2' ' B' ' 129' ' ' LYS . 13.6 mt -149.33 171.3 16.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.934 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -110.07 147.99 32.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.904 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.454 HG11 HG22 ' B' ' 126' ' ' VAL . 11.1 m -148.66 179.69 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.127 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -141.88 160.94 53.98 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.589 0.709 . . . . 0.0 110.931 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 -12.8 33.67 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.701 2.267 . . . . 0.0 112.312 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.4 p -99.12 -22.78 15.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.867 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -62.12 -172.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.892 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 122' ' ' THR . . . . . 0.536 ' CG2' HG22 ' B' ' 155' ' ' THR . 1.4 p -133.9 169.46 17.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.075 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . 0.74 HG23 HD12 ' B' ' 143' ' ' LEU . 40.8 mm -61.91 -49.06 85.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.152 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -52.51 -35.61 53.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.906 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -50.31 74.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.887 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . 0.454 HG22 HG11 ' B' ' 117' ' ' VAL . 22.9 t -56.47 -25.09 20.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.146 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -77.42 -27.67 52.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.893 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.22 -30.33 54.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.072 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.501 ' HB2' HD13 ' B' ' 115' ' ' LEU . 0.1 OUTLIER -77.63 -29.03 51.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.83 -179.898 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . 0.852 HD11 HG21 ' B' ' 105' ' ' VAL . 46.6 mt -77.39 -28.33 16.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.135 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -53.82 -48.23 70.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.885 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -68.81 -11.78 60.8 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.793 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . 0.431 ' HD3' HD21 ' B' ' 115' ' ' LEU . 6.8 mptt -93.09 -66.07 0.95 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.928 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.16 -45.79 17.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.832 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.82 35.67 1.98 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.463 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . 0.756 HD13 HD11 ' B' ' 171' ' ' LEU . 0.5 OUTLIER -127.87 142.88 45.73 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.594 0.711 . . . . 0.0 111.131 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 145.64 57.42 Favored 'Trans proline' 0 C--O 1.231 0.132 0 C-N-CA 122.708 2.272 . . . . 0.0 112.302 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 138' ' ' PRO . . . . . 0.415 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 54.0 Cg_endo -69.78 -13.18 34.26 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.724 2.282 . . . . 0.0 112.324 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -82.8 -1.03 50.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.813 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -122.27 -38.12 2.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.924 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . 0.502 ' OE1' HD21 ' B' ' 169' ' ' LEU . 14.9 pt20 -83.72 153.88 23.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.913 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 19.0 mmt85 -138.33 179.64 6.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.9 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . 0.78 HD22 ' HB3' ' B' ' 167' ' ' LEU . 21.2 mt -129.99 152.43 49.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.893 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.599 HD13 ' O ' ' B' ' 143' ' ' LEU . 23.8 mm -137.24 118.31 17.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.13 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 145' ' ' PHE . . . . . 0.744 ' CB ' HD11 ' B' ' 150' ' ' LEU . 26.2 t80 -155.6 146.89 22.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.879 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 65.41 23.41 11.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.063 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . 0.614 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 66.01 29.36 74.84 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.466 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -143.0 154.8 44.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.799 0.333 . . . . 0.0 110.853 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -78.23 109.8 12.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.902 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.744 HD11 ' CB ' ' B' ' 145' ' ' PHE . 5.2 mt -77.25 133.75 38.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.863 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -154.67 173.16 16.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.949 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.89 -25.5 11.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.805 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -50.35 -28.36 13.93 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.51 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 13.9 mtt-85 -137.15 147.58 46.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.884 0.373 . . . . 0.0 110.92 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 155' ' ' THR . . . . . 0.536 HG22 ' CG2' ' B' ' 122' ' ' THR . 30.2 p -82.66 -179.48 7.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.123 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . 0.476 HD13 HD12 ' B' ' 161' ' ' ILE . 4.4 mm? -63.07 -47.52 82.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.882 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 27.9 p -59.53 -32.28 70.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.936 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -59.69 -30.86 69.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.843 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 159' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -100.61 11.74 38.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.929 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 10.4 t30 51.37 30.33 5.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.903 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 161' ' ' ILE . . . . . 0.476 HD12 HD13 ' B' ' 156' ' ' LEU . 72.1 mt -68.98 110.45 2.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.16 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 61.0 mm-40 -93.34 -169.75 2.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.969 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 32.6 tttt -70.22 155.58 40.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.926 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 51.88 52.06 15.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.868 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.2 p -87.13 152.87 21.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.825 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.5 84.19 1.93 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.123 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.78 ' HB3' HD22 ' B' ' 143' ' ' LEU . 2.5 mt -94.42 140.58 29.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.957 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -93.09 155.57 17.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.867 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . 0.54 ' HB3' HG22 ' B' ' 107' ' ' THR . 0.4 OUTLIER -114.64 117.49 31.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 -179.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 170' ' ' VAL . . . . . 0.895 HG13 ' HB2' ' A' ' 36' ' ' ALA . 90.6 t -121.98 127.65 75.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.176 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.756 HD11 HD13 ' B' ' 136' ' ' ILE . 0.1 OUTLIER -109.21 119.81 40.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.886 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -111.26 77.85 1.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.839 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 16.6 mt -52.76 171.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.917 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -123.0 51.45 1.43 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.879 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -162.21 -50.95 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.535 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.298 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.447 -179.935 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.5 p . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.927 0.394 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -131.9 26.19 4.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.878 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.6 mpt? -129.58 37.83 3.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.94 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -51.57 109.36 0.79 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.536 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.72 ' HB1' HD11 ' A' ' 22' ' ' LEU . . . -125.53 -175.31 3.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.786 0.327 . . . . 0.0 111.111 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.667 ' HB3' HG21 ' A' ' 27' ' ' VAL . . . -79.18 -168.89 1.64 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.069 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.567 ' C ' HD23 ' A' ' 8' ' ' LEU . . . -83.39 -4.65 58.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.105 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.913 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -143.18 137.62 29.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.935 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -102.24 -3.99 26.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.856 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -148.47 123.8 10.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.854 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HA ' ' HD2' ' A' ' 12' ' ' PRO . 7.9 t -51.68 107.34 0.8 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.575 0.702 . . . . 0.0 110.955 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 11' ' ' CYS . 53.7 Cg_endo -69.74 -2.9 10.94 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.684 2.256 . . . . 0.0 112.318 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 28.1 mtm -92.35 -55.07 3.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.928 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 20.3 p -110.59 18.2 19.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.881 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 43.79 61.25 2.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.946 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.4 ttpt -123.2 111.22 16.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.908 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -59.6 116.48 4.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.854 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.499 ' CE2' HG13 ' A' ' 27' ' ' VAL . 45.4 m-85 -68.26 153.17 44.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.871 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.4 ' O ' HD23 ' A' ' 22' ' ' LEU . . . -58.38 150.26 55.36 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.598 0.713 . . . . 0.0 111.059 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 169.21 19.4 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.665 2.243 . . . . 0.0 112.38 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.8 ptt85 39.94 39.66 0.62 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.897 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.72 HD11 ' HB1' ' A' ' 5' ' ' ALA . 0.8 OUTLIER -83.8 -176.4 6.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.922 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.3 p -129.25 162.55 27.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.206 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -51.89 -34.27 40.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.892 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.516 ' O ' HD13 ' A' ' 25' ' ' LEU . 0.3 OUTLIER -72.26 -32.91 67.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.938 179.992 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -61.3 -55.79 27.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.839 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.667 HG21 ' HB3' ' A' ' 6' ' ' ALA . 98.4 t -64.89 -32.45 58.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.137 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -71.41 -34.21 70.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.828 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 75.6 m -61.39 -53.84 51.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.869 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -69.75 -40.52 76.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.859 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.913 HD11 HD11 ' A' ' 8' ' ' LEU . 11.4 mt -52.09 -50.02 62.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.901 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.424 ' HB2' ' HB3' ' B' ' 168' ' ' HIS . . . -52.97 -50.71 63.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.086 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -62.36 -52.05 65.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.921 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -38.93 64.97 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.526 1.141 . . . . 0.0 108.334 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.685 ' HB3' HG11 ' B' ' 170' ' ' VAL . 0.4 OUTLIER -56.24 -58.34 8.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.907 179.945 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.832 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -57.75 -29.86 65.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.088 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -93.1 7.19 45.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.905 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 t -82.25 129.74 34.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.904 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 17.6 p -67.79 -24.44 65.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.105 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -139.64 128.09 22.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.855 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -81.36 83.35 6.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.872 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.8 m -99.22 173.28 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.128 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.1 m -122.3 128.17 50.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.19 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 41.2 p90 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.001 179.928 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.927 0.394 . . . . 0.0 110.868 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 6.7 p-80 -117.99 -175.35 2.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.833 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 7.4 ptt? -98.58 173.56 6.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.838 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -123.67 157.19 34.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.904 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' ILE . . . . . 0.53 HD13 HG21 ' B' ' 117' ' ' VAL . 31.7 pt -143.49 163.28 16.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.109 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -123.18 115.88 22.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.871 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' VAL . . . . . 0.887 HG21 HD11 ' B' ' 130' ' ' ILE . 44.7 t -104.87 120.04 54.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.128 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -112.24 140.43 46.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' THR . . . . . 0.666 HG22 HD22 ' B' ' 169' ' ' LEU . 43.9 p -94.61 -179.25 4.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.137 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . 0.546 HD13 ' O ' ' B' ' 169' ' ' LEU . 6.1 mp -78.1 -3.47 42.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.866 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 29.6 p -90.45 -1.74 57.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.183 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 92.69 -19.91 48.2 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.389 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 14.2 ttmm -61.16 139.32 58.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.835 0.35 . . . . 0.0 110.949 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 4.7 m -112.57 125.33 54.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.154 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 51.6 mt -110.0 142.47 22.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.151 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 29.1 m -124.15 107.56 11.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.189 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.774 HD13 ' HG3' ' B' ' 129' ' ' LYS . 11.6 mt -127.28 165.41 19.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.907 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -102.28 144.31 30.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.862 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.581 HG11 HG22 ' B' ' 126' ' ' VAL . 10.9 m -140.76 153.84 21.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.157 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -99.51 156.23 35.62 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.706 0.765 . . . . 0.0 110.907 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.82 -13.88 35.13 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.666 2.244 . . . . 0.0 112.341 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 84.3 p -105.07 -9.33 17.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.918 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.425 ' C ' HD23 ' B' ' 156' ' ' LEU . 58.0 m-20 -68.16 -174.6 0.51 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.867 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 122' ' ' THR . . . . . 0.611 HG22 HG22 ' B' ' 155' ' ' THR . 24.2 p -132.45 175.18 9.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.175 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . 0.832 HG22 ' HE3' ' B' ' 127' ' ' LYS . 32.7 mm -62.79 -46.84 95.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.091 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -53.94 -32.77 54.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.876 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.24 -43.13 82.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.914 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . 0.581 HG22 HG11 ' B' ' 117' ' ' VAL . 42.6 t -56.18 -36.27 45.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.23 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 127' ' ' LYS . . . . . 0.832 ' HE3' HG22 ' B' ' 123' ' ' ILE . 40.0 mttt -78.79 -28.65 44.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.869 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.74 -51.88 67.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.049 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.774 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -71.33 -37.95 71.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.912 179.963 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . 0.887 HD11 HG21 ' B' ' 105' ' ' VAL . 57.3 mt -57.92 -29.18 35.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.136 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -57.27 -47.5 81.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.859 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -69.5 -11.49 60.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.828 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . 0.549 ' CE ' HD21 ' B' ' 115' ' ' LEU . 12.0 mptt -88.72 -66.49 0.91 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.844 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -83.34 -45.32 13.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.858 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 111.28 41.77 1.13 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.445 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . 0.489 HD13 HD11 ' B' ' 171' ' ' LEU . 0.7 OUTLIER -133.82 142.15 42.56 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.61 0.719 . . . . 0.0 111.092 -179.987 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 144.32 53.4 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.732 2.288 . . . . 0.0 112.297 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.84 -12.92 33.7 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.695 2.263 . . . . 0.0 112.269 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -83.0 -0.58 49.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.885 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -120.95 -38.4 2.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.87 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . 0.646 ' OE1' HD11 ' B' ' 169' ' ' LEU . 18.2 pt20 -83.62 154.2 23.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.972 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 41.5 mtt85 -135.53 174.78 10.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.839 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . 0.793 HD23 HD12 ' B' ' 150' ' ' LEU . 6.7 tp -121.83 153.96 37.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.894 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.556 HD13 ' O ' ' B' ' 143' ' ' LEU . 30.8 mm -139.62 108.33 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.094 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 145' ' ' PHE . . . . . 0.784 ' HB2' HD23 ' B' ' 167' ' ' LEU . 23.6 t80 -144.87 146.28 31.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.859 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 64.07 23.4 13.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.099 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . 0.626 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 72.73 6.07 65.99 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.488 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.6 155.52 36.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.72 0.295 . . . . 0.0 110.897 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -83.68 111.78 19.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.899 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.793 HD12 HD23 ' B' ' 143' ' ' LEU . 1.6 mt -79.16 135.63 36.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.915 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -139.88 177.58 7.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.884 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -63.24 -16.98 61.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.822 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.4 -17.29 46.65 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.483 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 8.4 mtt180 -136.85 167.51 21.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.827 0.346 . . . . 0.0 110.898 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 155' ' ' THR . . . . . 0.611 HG22 HG22 ' B' ' 122' ' ' THR . 74.0 p -103.17 -179.7 4.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.073 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . 0.791 HD13 HD12 ' B' ' 161' ' ' ILE . 4.5 mm? -65.37 -47.86 74.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.953 179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 16.1 t -65.7 -18.27 65.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.838 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.23 -31.18 63.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.847 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 159' ' ' TYR . . . . . 0.505 ' CG ' HD22 ' B' ' 150' ' ' LEU . 33.3 m-85 -100.4 13.42 34.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.932 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 160' ' ' ASN . . . . . 0.472 ' ND2' HE22 ' B' ' 162' ' ' GLN . 17.0 t30 50.82 43.74 28.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.877 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 161' ' ' ILE . . . . . 0.791 HD12 HD13 ' B' ' 156' ' ' LEU . 92.1 mt -82.22 108.3 15.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.135 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 162' ' ' GLN . . . . . 0.472 HE22 ' ND2' ' B' ' 160' ' ' ASN . 14.7 mp0 -89.34 178.51 6.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.894 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 30.5 tttm -64.84 150.93 46.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.884 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 59.49 34.85 22.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.96 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.8 m -75.9 135.23 40.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.88 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.51 110.15 22.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.059 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.784 HD23 ' HB2' ' B' ' 145' ' ' PHE . 0.5 OUTLIER -121.75 155.54 35.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.882 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 168' ' ' HIS . . . . . 0.424 ' HB3' ' HB2' ' A' ' 32' ' ' ALA . 1.1 m80 -103.18 151.16 22.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.829 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . 0.666 HD22 HG22 ' B' ' 107' ' ' THR . 3.4 tp -109.61 147.57 32.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.891 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 170' ' ' VAL . . . . . 0.832 HG13 ' HB2' ' A' ' 36' ' ' ALA . 25.3 t -142.95 126.43 14.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.153 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.489 HD11 HD13 ' B' ' 136' ' ' ILE . 0.4 OUTLIER -106.22 119.8 40.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.925 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.15 77.85 1.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.829 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 12.4 mt -52.28 126.81 20.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.898 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 18.9 ttt180 -109.51 114.3 27.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.934 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 109.03 -60.77 0.32 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.47 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.46 -179.914 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.6 p . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.902 0.382 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -130.36 106.63 8.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.876 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 12.8 mtt -114.25 -75.11 0.6 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.87 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 157.58 -139.18 6.23 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.479 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -131.51 112.69 12.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.719 0.295 . . . . 0.0 111.112 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.592 ' HB1' HG21 ' A' ' 27' ' ' VAL . . . -175.1 115.43 0.15 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.098 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.451 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . -60.53 -21.5 62.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.063 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.935 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -139.74 157.37 45.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.876 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -123.46 10.22 9.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.839 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.3 m -154.49 119.26 4.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.854 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 35.1 t -51.31 107.25 0.78 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.569 0.699 . . . . 0.0 110.879 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.408 ' HD2' HD21 ' A' ' 31' ' ' LEU . 53.0 Cg_endo -69.77 -2.51 10.31 Favored 'Trans proline' 0 N--CA 1.465 -0.188 0 C-N-CA 122.693 2.262 . . . . 0.0 112.348 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.4 ttm -91.45 -53.76 4.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.875 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.3 p -116.08 21.55 13.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.898 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.04 67.54 0.62 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.939 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 tppt? -124.41 107.71 11.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.877 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -59.23 112.1 1.59 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.839 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.68 ' CE2' HG13 ' A' ' 27' ' ' VAL . 41.5 m-85 -64.59 152.81 41.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.84 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -71.66 148.23 92.56 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.521 0.677 . . . . 0.0 111.114 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 167.97 22.95 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.626 2.217 . . . . 0.0 112.335 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 60.46 17.74 7.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.459 ' C ' HD12 ' A' ' 22' ' ' LEU . 0.6 OUTLIER -76.8 -174.9 3.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.949 -179.986 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.2 p -139.8 169.9 16.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.181 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -52.2 -34.36 45.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.895 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 13.8 tp -72.19 -31.9 66.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.899 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.57 -60.54 3.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.872 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.68 HG13 ' CE2' ' A' ' 18' ' ' PHE . 21.0 t -57.15 -36.51 51.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.153 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -71.65 -41.01 69.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.876 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.5 m -51.54 -53.79 34.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.897 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -68.52 -49.98 55.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.893 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.935 HD11 HD11 ' A' ' 8' ' ' LEU . 12.6 mt -53.12 -25.54 13.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.874 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.08 -49.85 33.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.124 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -30.98 63.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.937 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.6 t -71.37 -23.08 61.83 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.454 1.096 . . . . 0.0 108.325 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 45.3 tp -84.93 -50.06 7.82 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.907 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.997 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -66.94 -15.9 63.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.071 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.32 -25.38 14.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.903 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 56.7 p -72.54 168.2 19.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.862 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.43 4.13 13.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.192 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -117.72 159.17 23.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.885 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -124.77 65.17 1.11 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.906 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 20.7 m -89.53 133.97 30.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.188 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.0 m -99.7 119.74 38.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.159 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.472 ' HZ2' HD13 ' A' ' 31' ' ' LEU . 36.8 p90 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.909 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.899 0.38 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -116.33 114.31 24.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.893 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.7 ptt? -96.07 164.73 12.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.899 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -115.29 158.95 21.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.968 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 22.8 pt -149.76 155.25 8.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.122 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -121.95 141.25 51.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.934 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' VAL . . . . . 0.812 HG11 HD23 ' B' ' 169' ' ' LEU . 93.1 t -131.58 113.58 23.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.161 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -99.26 132.91 44.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' THR . . . . . 0.41 HG22 ' HB3' ' B' ' 169' ' ' LEU . 68.0 p -87.44 175.75 7.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.099 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 13.6 mt -73.74 -10.3 59.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.902 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 24.4 p -90.38 -12.72 36.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.066 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 107.59 -14.72 38.65 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.464 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 2.9 ttmp? -51.8 148.29 5.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.966 0.412 . . . . 0.0 110.893 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 23.1 m -125.69 104.07 8.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.177 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 57.0 mt -96.93 141.99 14.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.146 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 90.6 m -130.05 108.83 10.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.21 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.681 HD13 ' HG3' ' B' ' 129' ' ' LYS . 13.8 mt -130.18 170.48 14.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.83 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -114.43 148.14 38.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.845 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.776 HG11 HG22 ' B' ' 126' ' ' VAL . 11.0 m -140.12 178.75 3.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.174 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -122.05 160.57 46.78 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.58 0.705 . . . . 0.0 110.886 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 -20.68 34.18 Favored 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.686 2.258 . . . . 0.0 112.299 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 57.4 m -96.83 -6.92 34.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.858 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -73.0 -175.78 1.88 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.918 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 122' ' ' THR . . . . . 0.493 ' CG2' HG22 ' B' ' 155' ' ' THR . 5.2 p -135.07 164.34 27.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.189 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . 0.823 HG22 ' HE2' ' B' ' 127' ' ' LYS . 38.2 mm -54.27 -38.8 40.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.149 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -60.77 -35.78 77.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.907 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.03 -41.88 94.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.857 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . 0.776 HG22 HG11 ' B' ' 117' ' ' VAL . 23.9 t -56.74 -38.4 58.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.072 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 127' ' ' LYS . . . . . 0.823 ' HE2' HG22 ' B' ' 123' ' ' ILE . 25.0 mttm -78.21 -28.94 48.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.76 -51.67 68.0 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.15 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.681 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -72.19 -39.23 68.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.935 179.919 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . 0.446 ' CG1' HD12 ' B' ' 115' ' ' LEU . 55.9 mt -57.02 -29.58 31.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.146 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -56.39 -46.13 80.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.925 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -69.72 -11.69 61.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.81 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . 0.559 ' HD3' HD11 ' B' ' 115' ' ' LEU . 10.0 mptt -89.61 -66.26 0.94 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.898 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 134' ' ' GLU . . . . . 0.429 ' OE1' HD12 ' B' ' 136' ' ' ILE . 1.1 tm-20 -81.81 -45.49 15.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.898 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.69 37.34 1.74 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.533 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . 0.627 HD13 HD11 ' B' ' 171' ' ' LEU . 0.6 OUTLIER -129.37 142.22 44.49 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.631 0.729 . . . . 0.0 111.184 179.982 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 144.36 53.65 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.61 2.206 . . . . 0.0 112.35 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 138' ' ' PRO . . . . . 0.406 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.6 Cg_endo -69.77 -14.64 36.33 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.724 2.283 . . . . 0.0 112.312 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -81.57 -0.71 43.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.857 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -121.49 -37.59 2.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.961 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . 0.467 ' HB2' HD11 ' B' ' 169' ' ' LEU . 18.7 pt20 -85.43 155.02 21.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.913 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 45.5 mtt180 -139.06 -178.67 5.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.902 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . 0.804 HD12 HG23 ' B' ' 123' ' ' ILE . 13.2 mt -130.0 153.98 47.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.539 HD13 ' O ' ' B' ' 143' ' ' LEU . 22.0 mm -136.14 119.31 22.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.066 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 145' ' ' PHE . . . . . 0.819 ' HB3' HD11 ' B' ' 150' ' ' LEU . 5.1 t80 -153.48 146.38 24.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.874 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 65.45 28.81 11.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.132 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . 0.691 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 69.62 8.88 60.91 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.505 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.36 159.98 37.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.665 0.269 . . . . 0.0 110.926 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.87 128.44 34.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.87 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.819 HD11 ' HB3' ' B' ' 145' ' ' PHE . 5.1 mt -96.93 130.06 44.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.926 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -131.12 178.56 6.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.88 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.74 -16.86 59.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.918 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -55.28 -22.73 31.09 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.464 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 6.0 mtp85 -137.22 167.9 20.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.906 0.384 . . . . 0.0 110.821 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 155' ' ' THR . . . . . 0.493 HG22 ' CG2' ' B' ' 122' ' ' THR . 64.1 p -99.19 -179.6 4.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.157 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . 0.621 HD12 HG21 ' B' ' 161' ' ' ILE . 3.7 mm? -65.06 -44.61 88.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.907 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 11.0 p -67.46 -18.31 65.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.894 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -76.84 -30.92 56.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.915 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 159' ' ' TYR . . . . . 0.591 ' CG ' HD22 ' B' ' 150' ' ' LEU . 27.7 m-85 -100.74 15.97 26.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.937 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 13.2 t30 57.88 34.21 24.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.905 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 161' ' ' ILE . . . . . 0.621 HG21 HD12 ' B' ' 156' ' ' LEU . 28.1 mm -68.93 109.08 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.183 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 81.1 mm-40 -101.24 173.47 6.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.955 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -61.02 140.38 57.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.868 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 58.63 48.93 11.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.879 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 3.3 m -82.96 137.92 34.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.872 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.67 96.63 8.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.148 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.589 ' HB3' HD22 ' B' ' 143' ' ' LEU . 6.0 mt -107.63 172.12 7.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.878 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 168' ' ' HIS . . . . . 0.492 ' O ' HD23 ' B' ' 143' ' ' LEU . 35.5 m-70 -132.39 170.06 15.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.846 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . 0.812 HD23 HG11 ' B' ' 105' ' ' VAL . 0.2 OUTLIER -121.57 119.11 30.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.952 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 170' ' ' VAL . . . . . 0.997 HG13 ' HB2' ' A' ' 36' ' ' ALA . 23.6 t -125.36 114.81 41.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.119 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.627 HD11 HD13 ' B' ' 136' ' ' ILE . 0.2 OUTLIER -99.76 119.36 38.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.94 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -111.13 77.96 1.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.861 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 9.0 mt -51.58 140.37 18.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.848 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 5.4 ppt_? -98.9 -26.28 14.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.901 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -93.39 24.01 27.39 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.463 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.351 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.422 -179.959 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.892 0.377 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 15.9 p80 -120.44 44.76 2.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.851 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 36.1 mtt -78.73 77.0 5.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.859 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.36 94.16 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.532 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -97.79 75.06 2.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.758 0.313 . . . . 0.0 111.091 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.544 ' CB ' HG21 ' A' ' 27' ' ' VAL . . . -172.58 158.81 4.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.138 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.438 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . -51.84 -34.48 40.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.082 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.958 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -134.29 129.83 36.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.893 -179.923 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.45 4.45 52.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.9 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.5 m -154.53 126.63 7.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.934 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HA ' ' HD2' ' A' ' 12' ' ' PRO . 11.2 t -52.14 108.23 1.03 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.693 0.759 . . . . 0.0 110.903 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.43 ' HD2' ' HA ' ' A' ' 11' ' ' CYS . 53.0 Cg_endo -69.86 -0.73 7.42 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.623 2.215 . . . . 0.0 112.298 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -96.26 -54.04 3.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.868 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.9 p -114.39 22.23 13.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.916 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.5 tp60 41.46 68.18 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.866 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.1 tppt? -125.08 103.88 8.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.911 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -56.31 107.99 0.43 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.881 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.687 ' CE2' HG13 ' A' ' 27' ' ' VAL . 36.2 m-85 -63.22 153.08 35.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.823 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.48 150.45 34.25 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.59 0.71 . . . . 0.0 111.067 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 168.6 21.22 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.642 2.228 . . . . 0.0 112.352 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 39.73 40.47 0.67 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.86 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.422 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -84.16 -176.49 6.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.967 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.9 p -129.46 164.4 23.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.107 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -52.35 -31.44 33.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.865 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.8 tp -71.92 -33.83 68.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.858 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.88 -59.51 4.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.871 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.687 HG13 ' CE2' ' A' ' 18' ' ' PHE . 21.7 t -57.59 -37.09 56.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.229 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -71.76 -36.29 70.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.878 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.6 m -54.92 -54.02 48.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.872 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -72.54 -43.12 63.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.87 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.958 HD11 HD11 ' A' ' 8' ' ' LEU . 13.5 mt -51.91 -31.81 30.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.883 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.34 -38.81 65.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.11 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -74.27 -45.58 46.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -53.1 -52.19 59.43 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.512 1.132 . . . . 0.0 108.271 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.657 HD12 HD11 ' B' ' 144' ' ' ILE . 17.0 mt -52.52 -56.21 16.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.911 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.817 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -57.94 -22.19 47.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.074 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -102.98 8.9 38.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.871 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.6 m -116.7 167.07 11.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.879 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.8 m -124.35 -33.54 3.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.142 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -51.16 -56.1 14.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.843 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 t0 63.72 54.49 1.82 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.899 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 29.4 m -81.64 165.11 2.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.128 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 6.1 m -115.01 117.07 29.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.095 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 33.5 p90 . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.972 179.93 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.864 0.364 . . . . 0.0 110.863 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -167.99 122.25 0.95 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.91 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.486 ' HE2' HG23 ' B' ' 117' ' ' VAL . 5.6 ptt? -100.69 170.73 8.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.903 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -119.84 141.72 49.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.934 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' ILE . . . . . 0.651 HD13 HG21 ' B' ' 117' ' ' VAL . 42.1 pt -134.43 164.86 33.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.094 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -122.43 149.11 44.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.876 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' VAL . . . . . 0.583 HG21 HD11 ' B' ' 130' ' ' ILE . 61.6 t -136.84 117.6 17.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.137 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.22 155.49 17.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.83 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' THR . . . . . 0.553 HG22 HD22 ' B' ' 169' ' ' LEU . 61.8 p -112.86 170.06 8.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.143 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . 0.408 HD11 ' CB ' ' A' ' 36' ' ' ALA . 63.7 mt -64.83 -15.8 62.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.937 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 24.0 p -90.43 -12.55 37.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.091 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 104.22 -8.98 49.57 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.508 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 8.6 ttmm -51.75 142.39 14.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.912 0.387 . . . . 0.0 110.881 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 27.8 m -112.34 106.42 14.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.157 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 71.8 mt -100.68 141.79 16.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.207 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 31.6 m -129.25 122.62 30.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.187 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.613 HD21 ' HE2' ' B' ' 133' ' ' LYS . 12.8 mt -144.49 170.57 15.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.883 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -109.77 151.31 27.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.917 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.651 HG21 HD13 ' B' ' 103' ' ' ILE . 4.1 m -146.7 174.71 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.098 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -122.15 161.32 43.45 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.621 0.724 . . . . 0.0 110.873 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 -9.21 25.52 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.712 2.275 . . . . 0.0 112.315 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 13.0 m -103.5 -19.35 14.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.861 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -59.34 -174.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.876 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 122' ' ' THR . . . . . 0.907 HG22 HG22 ' B' ' 155' ' ' THR . 59.2 p -142.13 172.87 12.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.105 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . 1.058 HG23 HD12 ' B' ' 143' ' ' LEU . 28.1 mm -58.35 -35.52 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.167 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -74.7 -25.02 58.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.876 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -74.45 -50.37 18.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.868 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . 0.411 HG23 HD11 ' B' ' 103' ' ' ILE . 2.4 p -56.59 -33.39 39.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.096 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -77.69 -28.46 51.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.945 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.49 -52.57 64.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.098 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.41 ' HD3' ' HA ' ' B' ' 126' ' ' VAL . 0.0 OUTLIER -70.98 -30.69 67.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 179.967 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . 0.583 HD11 HG21 ' B' ' 105' ' ' VAL . 47.5 mt -63.63 -29.37 47.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.082 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -58.15 -42.69 86.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.88 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -69.73 -11.44 60.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.872 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . 0.613 ' HE2' HD21 ' B' ' 115' ' ' LEU . 2.1 mptp? -90.92 -65.7 0.99 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.872 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -82.12 -45.48 15.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.911 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.3 42.35 1.18 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.472 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . 0.711 HD13 HD11 ' B' ' 171' ' ' LEU . 0.5 OUTLIER -136.78 143.1 41.3 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.688 0.756 . . . . 0.0 111.101 -179.976 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 144.79 55.33 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.707 2.272 . . . . 0.0 112.342 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 138' ' ' PRO . . . . . 0.405 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.8 Cg_endo -69.78 -12.74 33.47 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.693 2.262 . . . . 0.0 112.365 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -83.53 -0.3 49.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.869 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -119.6 -39.42 2.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.966 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . 0.405 ' HG2' ' HA ' ' B' ' 138' ' ' PRO . 19.5 pt20 -80.29 147.74 31.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.927 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -121.74 -178.46 3.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.89 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . 1.058 HD12 HG23 ' B' ' 123' ' ' ILE . 12.1 mt -136.39 147.98 47.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.918 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.677 HD13 ' O ' ' B' ' 143' ' ' LEU . 17.2 mm -134.0 125.71 49.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.126 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 145' ' ' PHE . . . . . 0.738 ' HB2' HD11 ' B' ' 150' ' ' LEU . 4.9 t80 -155.81 143.3 19.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.887 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 59.1 26.37 15.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.128 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . 0.643 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 71.89 9.54 70.9 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.45 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.87 151.37 40.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.785 0.326 . . . . 0.0 110.877 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -82.92 109.96 17.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.959 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.738 HD11 ' HB2' ' B' ' 145' ' ' PHE . 4.5 mt -75.86 132.69 40.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.944 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -128.25 159.44 35.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.906 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -53.29 -26.7 19.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.886 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -52.05 -25.92 18.49 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.502 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -118.37 167.64 11.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.896 0.379 . . . . 0.0 110.925 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 155' ' ' THR . . . . . 0.907 HG22 HG22 ' B' ' 122' ' ' THR . 65.0 p -110.57 -179.4 3.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.13 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . 0.591 HD13 HD12 ' B' ' 161' ' ' ILE . 3.7 mm? -64.28 -41.1 97.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.942 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 38.2 t -67.25 -19.73 65.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.859 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -75.42 -35.88 60.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 159' ' ' TYR . . . . . 0.415 ' CG ' HD22 ' B' ' 150' ' ' LEU . 40.5 m-85 -100.47 8.44 43.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.958 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 10.2 t30 51.23 45.02 28.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.916 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 161' ' ' ILE . . . . . 0.591 HD12 HD13 ' B' ' 156' ' ' LEU . 87.9 mt -78.98 105.31 8.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.098 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 64.7 mm-40 -89.62 -169.59 2.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.957 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 29.4 tttt -70.26 155.9 40.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.92 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 51.98 52.23 14.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.894 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 1.4 p -91.29 132.63 36.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.92 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 5.5 m -87.04 84.49 7.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.118 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.616 ' HB3' HD22 ' B' ' 143' ' ' LEU . 6.1 mt -97.92 134.71 40.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 56.5 m-70 -99.14 143.26 29.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.862 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . 0.9 HD21 HD12 ' B' ' 171' ' ' LEU . 2.2 tt -103.61 140.85 37.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.89 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 170' ' ' VAL . . . . . 0.817 HG13 ' HB2' ' A' ' 36' ' ' ALA . 11.4 t -138.57 111.17 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.08 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.9 HD12 HD21 ' B' ' 169' ' ' LEU . 0.1 OUTLIER -86.95 119.6 27.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.919 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 12.6 tpp85 -111.64 77.37 1.04 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.831 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 8.0 mp -51.76 167.83 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.861 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.77 118.05 34.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.886 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 110.77 -52.66 0.62 Allowed Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.472 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.489 -179.882 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 66.1 m . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.941 0.401 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -87.7 -31.73 19.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.838 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 5.7 ptm -134.99 153.06 52.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.869 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 129.17 -121.99 3.72 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.466 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 58.98 43.32 17.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.83 0.348 . . . . 0.0 111.066 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.468 ' HB1' HG21 ' A' ' 27' ' ' VAL . . . -172.57 154.88 3.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.073 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.423 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . -69.57 -31.95 70.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.121 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.64 HD12 ' HE2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -138.17 145.81 41.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.93 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.56 -1.54 21.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.842 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -154.29 123.25 6.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.886 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.9 t -51.24 106.58 0.67 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.594 0.711 . . . . 0.0 110.873 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.7 -3.8 12.71 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.703 2.269 . . . . 0.0 112.375 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.0 mtt -89.03 -54.82 3.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.86 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.0 p -113.91 19.49 16.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.955 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 44.44 67.19 0.72 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.853 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 tppt? -124.02 111.71 16.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.816 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -64.76 120.75 13.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.896 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.64 ' HE2' HD12 ' A' ' 8' ' ' LEU . 39.8 m-85 -75.77 153.28 37.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.868 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.39 152.19 45.12 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.564 0.697 . . . . 0.0 111.074 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 170.3 16.82 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.678 2.252 . . . . 0.0 112.335 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.6 39.04 0.46 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.901 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.543 HD22 HG22 ' A' ' 27' ' ' VAL . 0.5 OUTLIER -83.47 -179.12 7.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.864 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -125.76 163.95 21.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.078 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -51.29 -37.15 45.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.909 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.455 ' O ' HD13 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -71.59 -40.06 70.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.922 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -53.6 -46.4 70.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.885 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.624 HG13 ' CE2' ' A' ' 18' ' ' PHE . 11.8 t -71.28 -55.84 12.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.113 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.512 ' HA ' HD22 ' A' ' 31' ' ' LEU . 37.1 m-20 -51.43 -32.67 27.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.817 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.3 m -54.53 -54.63 38.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.84 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -70.15 -35.25 73.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.925 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.634 HD21 HD11 ' A' ' 8' ' ' LEU . 0.4 OUTLIER -53.89 -44.47 70.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.907 179.974 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.51 -33.72 76.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.048 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -73.82 -53.1 11.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.935 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -53.49 -56.96 12.6 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.5 1.125 . . . . 0.0 108.327 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.751 ' HG ' HG11 ' B' ' 170' ' ' VAL . 24.8 tp -52.34 -48.79 65.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.998 -1.001 . . . . 0.0 110.909 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.652 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -62.09 -22.04 65.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.115 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -99.39 -2.52 36.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.896 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -112.05 157.13 21.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.856 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.0 p -107.83 4.22 25.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.159 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -110.44 103.94 12.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.91 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -80.0 62.88 4.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.801 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.5 p -77.93 145.28 10.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.106 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 33.0 m -99.74 111.0 23.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.143 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 38.3 p90 . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.895 -179.997 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 5.3 m . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.907 0.384 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -134.66 -81.09 0.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.906 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -172.13 155.83 3.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.847 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -109.18 147.41 32.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.989 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' ILE . . . . . 0.49 HD13 HG21 ' B' ' 117' ' ' VAL . 44.4 pt -139.76 155.24 24.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.099 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -120.24 141.4 49.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.891 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' VAL . . . . . 0.578 HG21 HD11 ' B' ' 130' ' ' ILE . 39.0 t -129.0 125.64 63.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.067 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.23 154.23 18.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.917 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 39.5 p -111.54 175.24 5.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.093 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . 0.524 HD11 ' CB ' ' A' ' 36' ' ' ALA . 12.8 mt -71.55 -12.94 61.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.878 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 49.1 p -90.43 -12.62 36.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.156 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 102.7 -15.12 56.03 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.501 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 19.0 ttmt -51.74 155.22 1.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.885 0.374 . . . . 0.0 110.848 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 54.9 m -118.83 107.48 13.67 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.095 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 63.7 mt -97.11 141.89 14.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.142 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 11.6 m -129.2 131.2 47.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.161 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.818 HD13 ' HG3' ' B' ' 129' ' ' LYS . 17.8 mt -150.13 170.43 18.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.915 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -109.78 148.58 31.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.897 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.574 HG11 HG22 ' B' ' 126' ' ' VAL . 23.8 m -148.65 169.22 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.128 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -113.09 157.65 40.21 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.711 0.767 . . . . 0.0 110.825 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -10.39 28.38 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.667 2.245 . . . . 0.0 112.372 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 14.8 m -107.33 -13.05 15.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.834 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -63.86 -175.21 0.13 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.875 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 122' ' ' THR . . . . . 0.475 HG22 HG22 ' B' ' 155' ' ' THR . 21.6 p -132.1 165.99 22.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.121 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . 0.875 HG23 HD12 ' B' ' 143' ' ' LEU . 37.9 mm -57.51 -41.06 78.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.113 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -57.56 -33.23 67.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.872 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.52 -42.44 74.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.864 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . 0.574 HG22 HG11 ' B' ' 117' ' ' VAL . 36.1 t -56.67 -35.52 45.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.147 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 127' ' ' LYS . . . . . 0.793 ' HE2' HG22 ' B' ' 123' ' ' ILE . 34.3 mttm -78.56 -28.7 45.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.909 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.56 -51.88 66.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.064 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.818 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -71.57 -39.88 70.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.942 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . 0.578 HD11 HG21 ' B' ' 105' ' ' VAL . 51.6 mt -53.68 -29.92 18.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.114 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -60.78 -41.49 95.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.925 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -68.81 -11.49 60.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.819 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . 0.525 ' HD3' HD21 ' B' ' 115' ' ' LEU . 0.1 OUTLIER -93.86 -66.12 0.94 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.905 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -80.5 -46.44 15.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.863 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.27 35.03 2.19 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.495 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . 0.776 HD13 HD11 ' B' ' 171' ' ' LEU . 0.7 OUTLIER -124.97 142.07 40.11 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.579 0.704 . . . . 0.0 111.107 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.86 144.59 53.98 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.619 2.213 . . . . 0.0 112.338 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 138' ' ' PRO . . . . . 0.401 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 54.1 Cg_endo -69.77 -13.06 34.11 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.705 2.27 . . . . 0.0 112.36 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -82.62 -1.45 51.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.896 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -122.25 -38.14 2.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.9 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . 0.564 ' OE1' HD21 ' B' ' 169' ' ' LEU . 12.5 pt20 -83.38 153.66 24.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.908 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 29.0 mtt-85 -137.03 179.56 6.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.852 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . 0.875 HD12 HG23 ' B' ' 123' ' ' ILE . 13.0 mt -128.04 152.4 47.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.855 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.555 HD13 ' O ' ' B' ' 143' ' ' LEU . 23.7 mm -138.61 111.14 6.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.095 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 145' ' ' PHE . . . . . 0.726 ' HB3' HD11 ' B' ' 150' ' ' LEU . 4.2 t80 -146.35 145.43 30.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.854 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . 63.93 24.37 13.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.083 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 68.68 28.35 73.2 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.467 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -143.99 154.3 43.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.791 0.329 . . . . 0.0 110.905 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -84.46 109.7 18.1 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.857 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.726 HD11 ' HB3' ' B' ' 145' ' ' PHE . 3.8 mt -81.31 131.39 35.29 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.919 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -137.99 -179.66 5.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.95 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.02 -16.57 60.28 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.829 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -58.87 -19.01 42.14 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.512 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 14.1 mtp85 -140.31 167.79 21.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.859 0.361 . . . . 0.0 110.882 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 155' ' ' THR . . . . . 0.475 HG22 HG22 ' B' ' 122' ' ' THR . 41.4 p -101.2 -179.86 4.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.211 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . 0.64 HD12 HG21 ' B' ' 161' ' ' ILE . 3.7 mm? -64.06 -47.61 79.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.944 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 8.5 p -65.48 -16.29 63.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.842 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.44 -32.54 58.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.824 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 159' ' ' TYR . . . . . 0.714 ' CG ' HD22 ' B' ' 150' ' ' LEU . 33.0 m-85 -100.7 16.05 26.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.895 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 8.2 t30 59.08 34.97 23.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.898 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 161' ' ' ILE . . . . . 0.64 HG21 HD12 ' B' ' 156' ' ' LEU . 28.9 mm -68.61 104.22 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.151 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 65.8 mm-40 -96.42 175.63 6.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.895 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 38.1 tttt -60.5 141.82 56.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.883 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 63.99 35.95 10.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.858 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . 0.418 ' HB3' HD11 ' B' ' 167' ' ' LEU . 1.5 m -67.68 128.95 38.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.814 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 166' ' ' THR . . . . . 0.404 ' CG2' HD21 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -93.26 96.31 9.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.145 179.986 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.634 ' HB3' HD22 ' B' ' 143' ' ' LEU . 4.9 mp -106.76 166.76 10.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.949 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 168' ' ' HIS . . . . . 0.461 ' O ' HD23 ' B' ' 143' ' ' LEU . 91.2 m-70 -115.59 169.9 8.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.933 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . 0.598 HD13 ' N ' ' B' ' 170' ' ' VAL . 0.5 OUTLIER -123.28 129.66 51.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.919 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 170' ' ' VAL . . . . . 0.751 HG11 ' HG ' ' A' ' 35' ' ' LEU . 90.7 t -133.03 123.0 47.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.12 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.776 HD11 HD13 ' B' ' 136' ' ' ILE . 0.2 OUTLIER -106.66 118.46 36.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.922 179.926 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -111.23 77.73 1.06 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.851 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 14.4 mt -51.38 128.43 22.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.884 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -68.39 -49.93 56.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.887 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 130.05 68.42 0.11 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.511 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.376 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.505 -179.88 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 21.9 m . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.89 0.376 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 11.6 t60 -156.84 130.43 8.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.826 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -133.28 172.97 11.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.827 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 129.01 -16.3 5.79 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.505 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -94.84 37.67 1.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.824 0.345 . . . . 0.0 111.09 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.442 ' HB1' HG21 ' A' ' 27' ' ' VAL . . . -175.93 142.69 0.53 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.071 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.566 ' HB3' ' O ' ' B' ' 146' ' ' ALA . . . -87.95 -21.24 25.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.134 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.497 HD21 ' HA3' ' B' ' 147' ' ' GLY . 0.1 OUTLIER -132.05 130.26 41.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.918 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -92.76 -2.46 55.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.841 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -154.41 127.28 8.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 32.4 t -51.85 107.59 0.87 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.609 0.719 . . . . 0.0 110.958 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -2.65 10.5 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.704 2.269 . . . . 0.0 112.327 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.67 -54.68 3.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.844 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.4 p -114.03 21.09 15.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.896 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 43.17 66.08 0.85 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.869 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.3 tppt? -122.51 106.69 11.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.894 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -59.29 120.72 9.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.933 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.633 ' CE2' HG13 ' A' ' 27' ' ' VAL . 37.8 m-85 -76.83 153.24 35.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.892 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.69 154.06 68.02 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.579 0.704 . . . . 0.0 111.065 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.85 167.8 23.51 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.691 2.261 . . . . 0.0 112.287 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 39.96 40.11 0.69 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.84 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.52 HD22 HG22 ' A' ' 27' ' ' VAL . 0.4 OUTLIER -81.0 -177.31 6.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.993 179.989 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.8 p -128.92 163.62 24.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.155 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.1 -36.77 51.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.927 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.773 HD13 HG21 ' B' ' 166' ' ' THR . 4.3 tp -71.65 -32.18 67.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.925 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -62.68 -48.67 78.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.81 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.633 HG13 ' CE2' ' A' ' 18' ' ' PHE . 21.4 t -75.06 -38.72 43.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.13 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -65.07 -41.5 95.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.843 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.2 m -51.7 -53.91 34.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.841 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -70.45 -42.05 72.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.834 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.481 HD23 ' O ' ' A' ' 27' ' ' VAL . 1.3 mm? -53.24 -33.54 53.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.898 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.69 -39.07 67.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.105 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -72.28 -48.89 39.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.08 -52.16 61.84 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.553 1.158 . . . . 0.0 108.33 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.602 ' CD2' HD11 ' B' ' 144' ' ' ILE . 23.6 tp -55.73 -45.85 77.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.9 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.06 -24.51 62.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.15 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -89.64 -34.69 16.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.898 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.2 t -96.99 113.01 24.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.936 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.0 t -63.52 -27.26 69.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.149 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -61.83 134.29 56.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.852 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -113.29 58.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.899 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 42' ' ' VAL . 17.0 m -82.39 119.66 32.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.09 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.83 131.03 35.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.138 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 29.5 p90 . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.871 179.966 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.943 0.401 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -124.1 -174.61 3.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.871 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 7.9 ptt? -100.01 173.79 6.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.918 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -118.15 157.18 27.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.915 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' ILE . . . . . 0.447 HD11 HG11 ' B' ' 117' ' ' VAL . 14.7 pt -145.06 166.47 11.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.075 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -124.45 152.97 42.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.885 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' VAL . . . . . 0.963 HG21 HD11 ' B' ' 130' ' ' ILE . 62.1 t -134.74 132.27 54.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.116 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -108.69 136.46 48.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.945 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 2.3 p -99.3 164.1 12.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.167 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.9 mp -66.79 -13.88 62.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.893 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . 0.466 HG23 ' H ' ' B' ' 111' ' ' LYS . 5.1 t -90.2 -3.6 57.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.118 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 97.29 -27.55 18.03 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.471 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' LYS . . . . . 0.466 ' H ' HG23 ' B' ' 109' ' ' THR . 40.1 ttpt -52.49 140.22 23.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.814 0.34 . . . . 0.0 110.883 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 83.8 m -110.07 141.71 42.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.044 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 64.4 mt -125.36 141.99 43.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.164 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 13.9 m -125.69 110.33 13.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.15 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.618 HD11 ' HD3' ' B' ' 133' ' ' LYS . 11.6 mt -129.12 168.93 15.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -103.86 146.29 28.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.872 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.531 HG11 HG12 ' B' ' 126' ' ' VAL . 34.5 m -146.74 157.83 10.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.216 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 118' ' ' GLU . . . . . 0.413 ' HB3' ' HD2' ' B' ' 119' ' ' PRO . 8.0 mt-10 -100.83 155.6 36.14 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.622 0.725 . . . . 0.0 110.851 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 119' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' B' ' 118' ' ' GLU . 52.8 Cg_endo -69.78 -8.31 23.27 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.71 2.273 . . . . 0.0 112.326 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 3.6 m -109.56 -10.43 14.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.824 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -64.46 -174.03 0.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.854 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 22.9 p -130.55 176.52 8.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.101 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . 0.821 HG22 ' HE2' ' B' ' 127' ' ' LYS . 39.5 mm -65.3 -50.89 70.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.159 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -57.51 -20.3 30.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.857 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.84 -51.24 23.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.944 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . 0.74 HG22 ' O ' ' B' ' 123' ' ' ILE . 3.5 m -56.44 -24.76 19.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.101 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 127' ' ' LYS . . . . . 0.821 ' HE2' HG22 ' B' ' 123' ' ' ILE . 40.9 mttm -79.86 -31.79 40.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.892 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.59 -51.32 69.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.171 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.558 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -72.17 -39.97 68.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.82 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . 0.963 HD11 HG21 ' B' ' 105' ' ' VAL . 37.3 mt -58.06 -30.25 38.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.082 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -57.31 -45.13 84.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.901 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -71.97 -11.37 60.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.915 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . 0.618 ' HD3' HD11 ' B' ' 115' ' ' LEU . 0.1 OUTLIER -85.46 -66.13 0.93 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.895 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -85.07 -42.23 15.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.879 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.48 42.2 1.17 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.524 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -132.07 142.28 44.52 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.611 0.72 . . . . 0.0 111.089 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 143.84 52.06 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.68 2.253 . . . . 0.0 112.362 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 138' ' ' PRO . . . . . 0.413 ' HA ' ' HG2' ' B' ' 141' ' ' GLN . 53.8 Cg_endo -69.75 -12.68 33.41 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.624 2.216 . . . . 0.0 112.352 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -83.19 -1.07 52.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.91 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -121.86 -37.86 2.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.969 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . 0.528 ' OE1' HD11 ' B' ' 169' ' ' LEU . 18.0 pt20 -84.04 145.61 28.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.959 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 26.5 mmt85 -129.6 178.42 6.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.82 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . 0.744 HD21 HD22 ' B' ' 167' ' ' LEU . 6.6 tp -121.51 151.68 40.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.935 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.602 HD11 ' CD2' ' A' ' 35' ' ' LEU . 30.8 mm -139.65 110.36 4.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.109 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 145' ' ' PHE . . . . . 0.771 ' CB ' HD11 ' B' ' 150' ' ' LEU . 48.1 t80 -138.22 141.95 39.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.884 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . 0.566 ' O ' ' HB3' ' A' ' 7' ' ' ALA . . . 63.67 24.53 13.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.098 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . 0.497 ' HA3' HD21 ' A' ' 8' ' ' LEU . . . 71.48 13.34 74.13 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.439 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -123.54 166.27 15.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.729 0.299 . . . . 0.0 110.933 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -92.25 123.7 35.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.921 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.771 HD11 ' CB ' ' B' ' 145' ' ' PHE . 2.2 mt -96.91 130.99 44.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.898 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -128.09 170.14 13.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.843 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -60.78 -19.22 58.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.843 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -56.47 -22.24 37.63 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.497 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 15.9 mtt-85 -128.36 166.65 18.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.896 0.379 . . . . 0.0 110.883 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 69.8 p -101.2 -179.71 4.12 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.122 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . 0.496 HD13 HD12 ' B' ' 161' ' ' ILE . 3.9 mm? -64.97 -47.88 76.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.017 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 34.1 t -66.03 -15.72 63.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.815 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.79 -32.67 62.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.834 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 159' ' ' TYR . . . . . 0.523 ' CG ' HD22 ' B' ' 150' ' ' LEU . 37.1 m-85 -100.7 16.11 26.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.884 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 160' ' ' ASN . . . . . . . . . . . . . 9.4 t30 59.17 34.64 23.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.882 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 161' ' ' ILE . . . . . 0.514 HD11 HD13 ' B' ' 150' ' ' LEU . 77.9 mt -80.94 95.57 2.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.147 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 162' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -90.16 -169.5 2.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.982 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -62.55 150.09 41.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.88 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 51.18 55.83 8.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.895 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 2.3 m -89.86 132.47 35.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.873 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 166' ' ' THR . . . . . 0.773 HG21 HD13 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -92.49 94.35 9.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.087 -179.911 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.744 HD22 HD21 ' B' ' 143' ' ' LEU . 2.8 mp -112.82 142.2 45.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.949 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -97.62 169.96 9.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.841 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . 0.528 HD11 ' OE1' ' B' ' 141' ' ' GLN . 4.7 tp -120.9 143.04 49.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.878 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 170' ' ' VAL . . . . . 0.568 HG21 HD23 ' A' ' 35' ' ' LEU . 26.0 t -132.93 112.71 18.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.146 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.77 114.79 29.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 172' ' ' ARG . . . . . 0.565 ' HD3' HG12 ' B' ' 170' ' ' VAL . 0.5 OUTLIER -111.33 77.89 1.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.878 179.928 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 173' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.29 113.99 3.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.904 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.2 141.21 57.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.792 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -57.82 102.69 0.25 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.445 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.375 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.452 -179.973 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.0 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.917 0.389 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -83.13 -38.49 22.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.927 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 18.2 mmt -109.34 177.92 4.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.828 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 167.31 89.67 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.479 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -97.76 72.47 2.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.779 0.323 . . . . 0.0 111.135 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.43 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . -170.51 154.94 4.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.053 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.42 ' HB3' HD23 ' A' ' 8' ' ' LEU . . . -54.4 -34.41 61.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.117 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.84 HD11 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -133.09 133.38 42.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.919 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.66 2.04 49.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.917 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -154.26 125.55 7.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.818 -179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.6 t -51.98 108.02 0.97 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.679 0.752 . . . . 0.0 110.94 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -2.63 10.53 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.632 2.221 . . . . 0.0 112.346 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 15.6 mtm -93.08 -54.49 3.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.892 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 18.9 p -112.63 21.09 15.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.9 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 42.08 63.38 1.37 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.893 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -122.02 105.72 10.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.888 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -57.08 112.66 1.42 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.869 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.677 ' CE2' HG13 ' A' ' 27' ' ' VAL . 35.6 m-85 -66.27 153.56 42.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.861 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.91 152.74 47.75 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.564 0.697 . . . . 0.0 111.136 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 168.1 22.54 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.684 2.256 . . . . 0.0 112.325 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.57 40.69 0.65 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.817 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.502 HD23 ' HB3' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -82.41 -176.89 6.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.998 179.917 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.1 p -129.31 162.24 28.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.166 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 21.8 mm100 -51.09 -36.23 39.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.882 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.628 HD22 HG21 ' B' ' 166' ' ' THR . 17.0 tp -71.85 -34.27 69.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.916 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -60.09 -50.56 73.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.856 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.677 HG13 ' CE2' ' A' ' 18' ' ' PHE . 60.7 t -71.09 -30.27 40.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.134 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -71.21 -43.2 67.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.823 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.4 m -51.67 -53.98 33.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.893 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -68.26 -44.89 74.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.833 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.84 HD11 HD11 ' A' ' 8' ' ' LEU . 11.5 mt -52.47 -36.57 55.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.905 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.32 -41.68 96.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.125 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.548 HE21 HD21 ' B' ' 108' ' ' LEU . 1.8 mm-40 -74.06 -50.0 21.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.903 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.28 -42.23 69.79 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.473 1.108 . . . . 0.0 108.24 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.454 HD23 HG11 ' B' ' 170' ' ' VAL . 23.1 tp -64.66 -49.71 69.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.954 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.72 ' HB2' HG13 ' B' ' 170' ' ' VAL . . . -60.82 -23.1 64.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.066 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -93.71 -21.45 19.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.885 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.1 t -70.47 153.69 42.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.872 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -105.82 -17.68 14.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.192 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -114.18 132.75 55.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.887 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -88.97 70.34 8.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.884 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.7 m -81.84 127.09 39.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.159 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.1 m -90.32 118.25 29.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.18 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 33.4 p90 . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.887 -179.977 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 49.7 p . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.865 0.364 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -164.95 126.31 2.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.856 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.498 ' HE2' HG23 ' B' ' 117' ' ' VAL . 10.3 ptt? -106.51 172.45 6.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.938 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -127.76 159.68 34.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.924 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 41.5 pt -142.92 162.68 17.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.107 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -126.91 119.23 26.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.85 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' VAL . . . . . 0.68 HG11 HD23 ' B' ' 169' ' ' LEU . 21.9 t -108.31 118.52 56.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.137 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.08 126.54 43.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.898 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' THR . . . . . . . . . . . . . 79.0 p -64.42 173.68 1.99 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.145 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . 0.548 HD21 HE21 ' A' ' 33' ' ' GLN . 3.6 tp -79.95 -1.16 38.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.935 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.7 t -105.93 -12.9 15.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.142 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 120.55 -25.45 7.28 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.453 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -48.68 138.63 10.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.809 0.338 . . . . 0.0 110.916 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 90.6 m -108.77 119.63 40.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.215 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' ILE . . . . . 0.53 HD11 ' CG ' ' B' ' 134' ' ' GLU . 62.3 mt -109.11 142.41 21.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.111 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 19.8 m -128.0 125.74 39.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.135 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.641 HD21 ' CE ' ' B' ' 133' ' ' LYS . 13.2 mt -146.99 159.48 43.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -96.79 140.68 31.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.875 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.623 HG11 HG12 ' B' ' 126' ' ' VAL . 34.0 m -144.43 156.58 14.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.126 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -103.95 161.61 22.43 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.623 0.725 . . . . 0.0 110.903 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 -24.43 29.64 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.716 2.278 . . . . 0.0 112.353 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 56.9 p -90.28 -12.35 38.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.828 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.466 ' C ' HD23 ' B' ' 156' ' ' LEU . 71.5 m-20 -61.57 -174.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.899 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 122' ' ' THR . . . . . 0.795 HG22 HG22 ' B' ' 155' ' ' THR . 33.8 p -137.25 162.16 34.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.21 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 123' ' ' ILE . . . . . 0.455 ' O ' HG22 ' B' ' 126' ' ' VAL . 41.8 mm -55.07 -34.72 32.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.159 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -72.39 -20.49 61.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -75.93 -52.78 9.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.925 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . 0.623 HG12 HG11 ' B' ' 117' ' ' VAL . 3.8 m -56.8 -28.23 27.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.165 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 9.6 mmtt -78.6 -29.62 46.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.923 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.47 -51.78 68.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.046 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.621 ' HG3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -70.77 -39.63 73.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.927 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . 0.537 HD11 HG21 ' B' ' 105' ' ' VAL . 40.9 mt -54.88 -31.3 24.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.163 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -57.44 -43.19 83.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.899 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -72.67 -12.39 61.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.868 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . 0.641 ' CE ' HD21 ' B' ' 115' ' ' LEU . 3.2 mptp? -88.14 -64.39 1.15 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.941 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 134' ' ' GLU . . . . . 0.53 ' CG ' HD11 ' B' ' 113' ' ' ILE . 0.3 OUTLIER -81.91 -44.83 16.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.899 179.922 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 110.32 39.65 1.48 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.459 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . 0.434 HG12 HD21 ' B' ' 171' ' ' LEU . 0.0 OUTLIER -135.29 147.75 63.45 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.613 0.72 . . . . 0.0 111.152 -179.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 137' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 143.03 49.75 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.667 2.245 . . . . 0.0 112.367 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.68 -9.98 27.49 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.725 2.284 . . . . 0.0 112.369 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -83.6 -0.19 49.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.863 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . 0.437 ' HG2' HD13 ' B' ' 173' ' ' LEU . 3.4 mt-30 -120.85 -39.29 2.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.869 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . 0.573 ' HB2' HD11 ' B' ' 169' ' ' LEU . 20.1 pt20 -83.67 147.94 27.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.9 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 82.8 mtt180 -138.82 172.12 13.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . 0.667 HD22 HD22 ' B' ' 167' ' ' LEU . 5.9 mt -114.06 153.58 29.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.887 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.604 HD13 ' O ' ' B' ' 143' ' ' LEU . 23.5 mm -137.45 103.25 2.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.179 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 145' ' ' PHE . . . . . 0.745 ' CB ' HD11 ' B' ' 150' ' ' LEU . 9.8 t80 -138.47 147.52 43.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.883 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' B' ' 145' ' ' PHE . . . 67.56 24.03 8.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.091 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . 0.611 ' O ' HD21 ' A' ' 8' ' ' LEU . . . 70.64 8.39 63.24 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.458 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.69 163.75 16.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.762 0.315 . . . . 0.0 110.916 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -89.1 109.83 20.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.896 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.745 HD11 ' CB ' ' B' ' 145' ' ' PHE . 3.6 mt -77.63 129.65 35.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.864 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 151' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -138.04 172.74 12.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.906 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -60.02 -19.21 51.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.87 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -57.27 -21.38 39.85 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.458 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 11.5 mtp180 -131.43 167.75 18.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.926 0.393 . . . . 0.0 110.865 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 155' ' ' THR . . . . . 0.795 HG22 HG22 ' B' ' 122' ' ' THR . 39.8 p -101.66 179.92 4.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.174 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . 0.85 HD13 HD12 ' B' ' 161' ' ' ILE . 4.2 mm? -65.87 -48.09 72.71 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.9 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 157' ' ' SER . . . . . . . . . . . . . 43.0 t -64.83 -20.59 66.48 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.856 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 158' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.2 -31.25 68.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.808 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 159' ' ' TYR . . . . . 0.49 ' CG ' HD22 ' B' ' 150' ' ' LEU . 36.2 m-85 -100.78 13.54 34.6 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.882 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 160' ' ' ASN . . . . . 0.432 ' ND2' HE22 ' B' ' 162' ' ' GLN . 14.5 t30 50.81 44.58 27.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.878 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 161' ' ' ILE . . . . . 0.85 HD12 HD13 ' B' ' 156' ' ' LEU . 92.3 mt -83.03 111.15 18.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.167 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 162' ' ' GLN . . . . . 0.432 HE22 ' ND2' ' B' ' 160' ' ' ASN . 14.7 mp0 -93.79 -176.2 3.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.858 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 36.0 tttt -69.43 145.37 52.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.912 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 62.91 36.94 12.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.94 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 2.3 m -72.83 139.36 46.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.875 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 166' ' ' THR . . . . . 0.628 HG21 HD22 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -97.09 107.22 19.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.153 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.667 HD22 HD22 ' B' ' 143' ' ' LEU . 1.1 mp -126.5 172.85 9.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.91 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 168' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -121.59 169.6 10.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.863 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . 0.68 HD23 HG11 ' B' ' 105' ' ' VAL . 0.2 OUTLIER -116.05 127.89 55.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.897 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 170' ' ' VAL . . . . . 0.72 HG13 ' HB2' ' A' ' 36' ' ' ALA . 16.1 t -125.53 114.21 38.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.09 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.511 HD12 HD12 ' B' ' 169' ' ' LEU . 0.0 OUTLIER -101.46 119.47 38.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.91 179.919 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 -111.06 96.46 6.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.892 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 173' ' ' LEU . . . . . 0.459 HD22 ' H ' ' B' ' 173' ' ' LEU . 1.5 mm? -84.72 145.72 27.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.906 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 174' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -75.76 102.77 5.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.853 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 151.88 -47.76 0.56 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.548 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.506 -179.987 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_