data_2l9g_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 2l9g _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 3.5 mtm180 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.788 0.328 . . . . 74.25 110.869 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.86 -2.23 57.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 75.11 110.875 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 19.0 mt -105.59 -19.46 13.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.254 -0.43 . . . . 75.55 110.94 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.4 pp -101.56 -20.48 15.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.204 -0.453 . . . . 72.35 110.904 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.531 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -69.91 -57.2 6.6 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.595 0.712 . . . . 75.33 111.142 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.75 -28.32 25.43 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.642 2.228 . . . . 71.14 112.353 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.9 mp -83.73 -23.85 31.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.246 -0.434 . . . . 73.41 110.934 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -51.89 -29.79 21.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 75.34 111.028 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -63.35 1.41 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 65.42 110.833 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.0 tp -51.34 -27.76 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 74.54 111.132 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.5 tp -55.2 -26.68 18.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.212 -0.449 . . . . 72.33 111.108 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.21 111.079 179.768 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.774 0.321 . . . . 74.25 110.85 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -18.7 46.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.202 -0.454 . . . . 75.11 110.894 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.86 -0.26 37.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 75.55 110.869 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -111.78 -24.06 10.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.197 -0.456 . . . . 72.35 110.969 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.491 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -69.5 -59.69 4.61 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 121.568 0.699 . . . . 75.33 111.143 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.1 Cg_endo -69.76 -23.62 30.6 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.668 2.245 . . . . 71.14 112.334 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.6 mp -89.51 -18.76 26.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.245 -0.434 . . . . 73.41 110.941 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -54.51 -26.01 29.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.161 -0.472 . . . . 75.34 111.058 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -74.06 -62.57 1.46 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 65.42 110.865 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.0 pt -61.66 -21.34 25.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.256 -0.429 . . . . 74.54 111.099 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.6 tp -52.21 -26.51 8.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.18 -0.464 . . . . 72.33 111.108 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 72.21 111.097 179.816 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.6 mtm-85 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.804 0.335 . . . . 74.25 110.866 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 22.4 mtt -64.26 -14.52 56.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 75.11 110.885 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt -101.23 -10.72 20.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 75.55 110.916 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.5 mt -98.79 -25.69 14.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.149 -0.478 . . . . 72.35 110.922 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.485 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -67.44 -59.61 6.87 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.538 0.685 . . . . 75.33 111.058 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.485 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.78 -21.19 33.75 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.611 2.207 . . . . 71.14 112.388 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.3 tt -87.53 -17.29 32.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 73.41 110.941 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -88.74 15.06 8.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 75.34 111.1 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -144.08 14.84 1.69 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.135 -0.484 . . . . 65.42 110.889 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 pp -117.08 -23.57 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.271 -0.422 . . . . 74.54 111.197 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.86 -17.16 21.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 72.33 111.117 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 72.21 111.135 179.735 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.709 0.29 . . . . 74.25 110.828 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 mtt -59.91 -18.26 43.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 75.11 110.899 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.82 0.27 35.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 75.55 110.912 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.2 mt -112.11 -22.04 11.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.137 -0.483 . . . . 72.35 110.926 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.477 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -72.75 -60.49 1.94 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.62 0.724 . . . . 75.33 111.185 179.877 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.4 Cg_endo -69.83 -20.48 34.47 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.641 2.227 . . . . 71.14 112.296 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.1 mp -109.24 6.5 24.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 73.41 110.93 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.25 -52.4 16.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.446 . . . . 75.34 111.16 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.89 36.79 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 65.42 110.944 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -125.54 19.08 4.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 74.54 111.154 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.86 6.29 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 72.33 111.131 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 72.21 111.098 179.807 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.526 0.055 0 CA-C-O 120.728 0.299 . . . . 74.25 110.835 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.5 ttt -72.98 -8.27 54.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 75.11 110.916 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 30.6 tp -102.67 -19.86 14.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.227 -0.442 . . . . 75.55 110.858 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -93.79 -23.84 18.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 72.35 110.85 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.521 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -67.89 -57.93 8.83 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.63 0.729 . . . . 75.33 111.164 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.521 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.67 -25.49 28.97 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.722 2.281 . . . . 71.14 112.36 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -88.17 -19.6 26.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 73.41 110.964 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -54.54 -26.43 31.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.466 . . . . 75.34 111.099 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -107.56 -30.23 8.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.435 . . . . 65.42 110.892 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.7 tp -54.93 -25.04 15.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 74.54 111.152 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.6 pt -64.97 -15.12 17.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.48 . . . . 72.33 111.071 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 72.21 111.123 179.791 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.769 0.318 . . . . 74.25 110.856 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -63.78 -15.86 59.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 75.11 110.903 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.85 -4.29 25.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 75.55 110.907 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 16.5 mt -106.6 -24.62 12.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 72.35 110.958 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.526 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -70.0 -57.79 5.9 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 121.548 0.69 . . . . 75.33 111.116 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.75 -19.9 35.57 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.717 2.278 . . . . 71.14 112.291 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.0 mp -89.56 -19.95 24.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.258 -0.428 . . . . 73.41 110.933 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.64 16.55 11.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.449 . . . . 75.34 111.061 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.09 -32.35 3.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 65.42 110.945 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.9 pt -72.04 -35.15 52.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 74.54 111.135 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.7 pt -59.8 -19.19 16.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 72.33 111.158 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.17 -0.468 . . . . 72.21 111.133 179.785 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.2 mpp_? . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.868 0.366 . . . . 74.25 110.86 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.2 ptp -72.51 -8.64 56.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 75.11 110.917 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.9 -19.66 14.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.446 . . . . 75.55 110.94 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -92.62 -24.59 18.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 72.35 110.928 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.527 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -67.85 -57.79 9.13 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.535 0.683 . . . . 75.33 111.103 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.71 -23.44 31.03 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.669 2.246 . . . . 71.14 112.335 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.99 -20.6 30.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 73.41 110.933 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -89.25 11.96 17.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 75.34 111.107 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.6 mmmt -136.94 9.34 3.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 65.42 110.928 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.8 pp -117.51 -18.64 6.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 74.54 111.158 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.92 -16.15 15.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.149 -0.478 . . . . 72.33 111.104 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.243 -0.435 . . . . 72.21 111.094 179.813 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.878 0.371 . . . . 74.25 110.874 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.23 -15.92 50.12 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.201 -0.454 . . . . 75.11 110.941 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.38 -6.63 22.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 75.55 110.926 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 15.9 mt -103.16 -21.81 13.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 72.35 110.909 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.461 ' CB ' ' CD ' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -73.05 -60.97 1.64 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.64 0.733 . . . . 75.33 111.199 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.81 -17.08 37.57 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.692 2.261 . . . . 71.14 112.336 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -112.43 5.61 18.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 73.41 110.94 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.03 -55.13 8.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 75.34 111.113 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.96 31.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.24 -0.436 . . . . 65.42 110.879 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -114.04 11.46 8.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.249 -0.432 . . . . 74.54 111.1 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.95 4.8 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.474 . . . . 72.33 111.134 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.467 . . . . 72.21 111.117 179.79 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.815 0.34 . . . . 74.25 110.891 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.8 mtt -80.3 -1.32 40.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.218 -0.446 . . . . 75.11 110.874 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 39.7 tp -105.2 -26.72 11.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 75.55 110.928 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 pp -90.33 -22.92 21.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 72.35 110.921 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.519 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.01 -58.02 8.5 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.589 0.709 . . . . 75.33 111.145 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.7 Cg_endo -69.77 -25.53 28.47 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.643 2.228 . . . . 71.14 112.363 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -87.56 -21.23 25.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 73.41 110.947 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -52.81 -28.29 21.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 75.34 111.106 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.25 -31.82 8.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 65.42 110.888 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.55 -26.42 9.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 74.54 111.177 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.6 pt -65.96 -34.08 67.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 72.33 111.104 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.227 -0.442 . . . . 72.21 111.07 179.838 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.133 0 CA-C-O 120.78 0.324 . . . . 74.25 110.925 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.7 ttp -64.8 -13.93 57.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 75.11 110.929 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 41.3 tp -100.6 -13.42 18.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 75.55 110.916 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -96.61 -25.09 15.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.152 -0.476 . . . . 72.35 110.873 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.483 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -66.99 -59.62 7.36 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 121.52 0.676 . . . . 75.33 111.178 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.5 Cg_endo -69.79 -22.53 31.79 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.72 2.28 . . . . 71.14 112.327 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -90.62 -17.04 27.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 73.41 110.923 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.49 -19.95 51.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 75.34 111.057 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.3 mptt -119.77 -27.1 5.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.248 -0.433 . . . . 65.42 110.856 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.7 tp -54.45 -27.23 17.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.281 -0.418 . . . . 74.54 111.119 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -62.64 -16.13 16.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 72.33 111.142 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.167 -0.47 . . . . 72.21 111.161 179.791 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.775 0.322 . . . . 74.25 110.872 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -11.04 60.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 75.11 110.867 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.48 -14.7 16.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 75.55 111.006 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.43 -26.03 15.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 72.35 110.902 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.512 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -66.93 -57.79 10.71 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.572 0.701 . . . . 75.33 111.179 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.79 -24.37 29.6 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.719 2.28 . . . . 71.14 112.341 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.8 tt -89.14 -17.96 28.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.21 -0.45 . . . . 73.41 110.89 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.61 -20.28 54.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 75.34 111.069 179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -119.23 -26.69 5.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 65.42 110.948 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.7 tp -54.73 -26.14 16.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 74.54 111.105 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.78 -14.49 15.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 72.33 111.11 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 72.21 111.074 179.843 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 120.776 0.322 . . . . 74.25 110.877 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.26 -1.35 40.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.473 . . . . 75.11 110.96 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.14 -26.67 11.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 75.55 110.96 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 pp -90.3 -22.9 21.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 72.35 110.94 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.516 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.02 -58.0 8.5 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.655 0.74 . . . . 75.33 111.146 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.74 -25.53 28.58 Favored 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.742 2.295 . . . . 71.14 112.353 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.5 tt -86.45 -19.09 30.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.231 -0.44 . . . . 73.41 110.947 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.56 -16.75 57.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.461 . . . . 75.34 111.066 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.4 pttt -114.37 -24.39 8.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.211 -0.45 . . . . 65.42 110.891 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.5 tp -58.37 -21.54 18.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.243 -0.435 . . . . 74.54 111.111 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -103.14 4.74 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.466 . . . . 72.33 111.12 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 72.21 111.087 179.86 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.775 0.321 . . . . 74.25 110.921 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.8 ttm -72.96 -8.33 55.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 75.11 110.882 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.74 -19.42 14.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 75.55 110.933 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 13.4 mt -94.77 -23.13 17.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.247 -0.433 . . . . 72.35 110.917 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.514 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.51 -57.88 7.89 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 121.599 0.714 . . . . 75.33 111.184 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.4 Cg_endo -69.85 -25.84 27.77 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.7 2.267 . . . . 71.14 112.307 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.2 tp -88.85 -18.48 27.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 73.41 110.946 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -51.32 -30.56 18.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.18 -0.464 . . . . 75.34 111.133 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -62.88 1.5 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 65.42 110.918 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.51 -26.14 9.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.269 -0.423 . . . . 74.54 111.12 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.7 tp -52.53 -26.25 9.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 72.33 111.101 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 72.21 111.156 179.746 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.815 0.341 . . . . 74.25 110.868 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -64.14 -14.79 57.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 75.11 110.879 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 mt -101.57 -9.72 20.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.194 -0.457 . . . . 75.55 110.923 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 21.6 mt -99.63 -25.43 14.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.175 -0.466 . . . . 72.35 110.917 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.494 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -68.33 -59.5 5.99 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.573 0.702 . . . . 75.33 111.162 179.96 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.7 -20.47 35.07 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.746 2.297 . . . . 71.14 112.356 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 28.1 tp -87.11 -21.06 26.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.223 -0.444 . . . . 73.41 110.977 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -90.88 43.75 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 75.34 111.089 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -168.62 -42.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 65.42 110.855 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.7 tp -55.01 -27.13 18.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.269 -0.423 . . . . 74.54 111.153 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -15.42 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 72.33 111.046 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 72.21 111.076 179.882 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.7 ttt180 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.762 0.315 . . . . 74.25 110.876 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -72.6 -8.63 56.23 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.231 -0.44 . . . . 75.11 110.859 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 11.4 mt -102.75 -19.53 14.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.235 -0.439 . . . . 75.55 110.939 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -93.37 -24.27 18.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.197 -0.456 . . . . 72.35 110.902 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.514 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -67.83 -57.87 9.02 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.582 0.706 . . . . 75.33 111.116 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.73 -23.96 30.33 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.705 2.27 . . . . 71.14 112.368 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -84.45 -24.55 29.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.454 . . . . 73.41 110.909 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.91 -18.31 60.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 75.34 111.117 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -92.6 -2.11 56.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 65.42 110.924 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 pp -128.0 -1.38 3.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 74.54 111.208 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.2 tp -79.78 -26.55 12.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.12 -0.491 . . . . 72.33 111.068 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 72.21 111.149 179.821 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.75 0.31 . . . . 74.25 110.813 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -81.11 -0.7 41.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 75.11 110.83 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.5 mt -105.56 -26.88 11.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.445 . . . . 75.55 110.921 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 pp -90.61 -22.74 21.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 72.35 110.969 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.522 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.31 -58.0 8.04 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.58 0.705 . . . . 75.33 111.1 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.522 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.4 Cg_endo -69.74 -25.54 28.57 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.762 2.308 . . . . 71.14 112.347 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.67 -21.68 25.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 73.41 110.985 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -51.41 -30.54 19.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 75.34 111.092 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -76.23 -59.78 2.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 65.42 111.0 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.53 -26.16 9.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 74.54 111.196 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.7 tp -52.5 -26.19 9.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 72.33 111.169 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.154 -0.476 . . . . 72.21 111.091 179.794 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.739 0.305 . . . . 74.25 110.858 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.2 ttm -66.88 -13.42 61.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.453 . . . . 75.11 110.869 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.41 -9.2 20.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.294 -0.412 . . . . 75.55 110.841 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -103.86 -23.57 13.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.212 -0.449 . . . . 72.35 110.942 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.523 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -69.16 -57.57 7.24 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.594 0.711 . . . . 75.33 111.123 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.523 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.81 -24.64 29.22 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.703 2.269 . . . . 71.14 112.282 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -82.05 -29.41 31.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.249 -0.432 . . . . 73.41 110.959 179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.13 58.73 1.61 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 75.34 111.115 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -178.7 -49.31 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.248 -0.433 . . . . 65.42 110.915 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.4 pt -64.43 -13.5 14.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 74.54 111.155 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.0 pt -58.33 -19.27 13.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 72.33 111.152 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.449 . . . . 72.21 111.129 179.793 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.782 0.325 . . . . 74.25 110.9 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 33.1 ttm -70.03 -10.74 59.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 75.11 110.846 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 48.9 mt -102.65 -15.49 16.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 75.55 110.914 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.89 -26.51 16.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.175 -0.466 . . . . 72.35 110.955 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.516 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -66.8 -57.66 11.23 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.548 0.69 . . . . 75.33 111.121 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.79 -22.95 31.24 Favored 'Trans proline' 0 N--CA 1.464 -0.232 0 C-N-CA 122.691 2.261 . . . . 71.14 112.386 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.6 tt -85.78 -21.55 28.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 73.41 110.915 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -83.52 3.98 29.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.233 -0.439 . . . . 75.34 111.088 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.56 -37.7 5.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 65.42 110.889 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.3 pt -67.65 -28.41 41.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 74.54 111.118 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.7 pt -87.47 43.14 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.208 -0.451 . . . . 72.33 111.134 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 72.21 111.064 179.828 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.872 0.368 . . . . 74.25 110.887 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.5 ptt? -85.73 -1.39 57.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.445 . . . . 75.11 110.884 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 84.6 mt -106.46 -20.29 13.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.243 -0.435 . . . . 75.55 110.888 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.5 pp -99.89 -21.04 15.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.235 -0.438 . . . . 72.35 110.943 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.525 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -70.05 -57.2 6.41 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.553 0.692 . . . . 75.33 111.155 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.72 -26.79 27.41 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.681 2.254 . . . . 71.14 112.354 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -80.68 -24.05 39.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 73.41 110.961 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -81.52 0.18 39.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.45 . . . . 75.34 111.052 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.22 2.08 13.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.291 -0.413 . . . . 65.42 110.907 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 pp -121.43 -10.62 9.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 74.54 111.174 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.7 pp -63.04 -15.65 16.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.142 -0.481 . . . . 72.33 111.159 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 72.21 111.088 179.779 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.792 0.33 . . . . 74.25 110.855 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.2 mtt -60.78 -18.09 53.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 75.11 110.938 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.4 mt -101.43 -0.73 34.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 75.55 110.856 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.93 -25.92 10.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.242 -0.436 . . . . 72.35 110.879 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.479 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -68.61 -59.58 5.59 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 121.592 0.711 . . . . 75.33 111.175 179.92 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.74 -21.68 33.24 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.722 2.281 . . . . 71.14 112.366 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -86.62 -21.58 26.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 73.41 110.896 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.99 58.02 1.44 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 75.34 111.094 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -166.15 -48.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 65.42 110.869 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -88.89 -1.4 8.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 74.54 111.107 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.8 pp -91.39 14.35 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 72.33 111.141 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 72.21 111.087 179.861 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.094 0 CA-C-O 120.812 0.339 . . . . 74.25 110.841 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 mtm -67.83 -12.73 61.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.167 -0.47 . . . . 75.11 110.86 179.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.2 mt -104.13 -6.69 20.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.28 -0.418 . . . . 75.55 110.901 -179.975 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 13.2 mt -108.17 -20.51 13.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 72.35 110.922 179.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.512 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -73.16 -58.33 2.52 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.544 0.688 . . . . 75.33 111.184 179.91 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.3 Cg_endo -69.73 -23.71 30.63 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.711 2.274 . . . . 71.14 112.387 179.873 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.8 mp -107.16 6.63 28.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 73.41 110.915 179.993 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -46.67 -53.24 12.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.471 . . . . 75.34 111.137 179.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.46 36.23 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.465 . . . . 65.42 110.917 179.997 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -125.16 18.95 4.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 74.54 111.122 179.851 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.53 6.19 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.19 -0.459 . . . . 72.33 111.134 179.851 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.493 . . . . 72.21 111.16 179.796 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.825 0.345 . . . . 74.25 110.934 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 27.7 mtm -64.16 -15.68 60.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 75.11 110.873 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.07 -4.96 25.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.231 -0.44 . . . . 75.55 110.916 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -108.22 -23.56 11.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 72.35 110.82 179.962 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.519 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -69.69 -57.93 6.15 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.672 0.749 . . . . 75.33 111.146 179.988 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.1 Cg_endo -69.73 -25.41 28.78 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.65 2.234 . . . . 71.14 112.379 179.913 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -85.6 -21.73 28.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 73.41 110.881 -179.982 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.14 -20.72 64.39 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.169 -0.468 . . . . 75.34 111.08 179.825 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.0 -29.26 11.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 65.42 110.906 179.976 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.22 -26.98 9.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.221 -0.445 . . . . 74.54 111.146 179.816 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.6 pt -67.02 -35.71 75.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 72.33 111.141 179.901 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 72.21 111.101 179.812 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 10.7 ttt180 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.789 0.328 . . . . 74.25 110.869 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -84.17 4.64 29.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 75.11 110.931 179.968 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.77 -5.94 13.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.48 . . . . 75.55 110.933 -179.971 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -110.57 -23.94 10.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 72.35 110.951 179.897 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.481 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -68.34 -59.5 5.98 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.547 0.689 . . . . 75.33 111.174 179.896 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.2 Cg_endo -69.78 -25.91 28.02 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.695 2.263 . . . . 71.14 112.387 179.902 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.1 tt -87.13 -19.33 28.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 73.41 110.973 179.902 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -52.43 -28.4 19.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 75.34 111.118 179.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -106.6 -32.25 8.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 65.42 110.908 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.0 tp -52.06 -26.47 8.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 74.54 111.208 179.839 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.7 pt -65.37 -36.03 76.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.114 -0.494 . . . . 72.33 111.189 179.781 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.189 -0.46 . . . . 72.21 111.078 179.808 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.771 0.319 . . . . 74.25 110.862 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.4 ttm -77.37 -4.38 44.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.449 . . . . 75.11 110.853 179.946 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 41.5 tp -107.69 -11.72 15.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.439 . . . . 75.55 110.957 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -106.86 -20.14 13.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.204 -0.453 . . . . 72.35 110.899 179.905 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.525 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -73.17 -57.92 2.67 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.596 0.713 . . . . 75.33 111.14 179.943 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.84 -23.88 29.95 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.634 2.222 . . . . 71.14 112.34 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.3 mp -106.51 5.87 29.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.454 . . . . 73.41 110.951 179.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.73 -51.92 20.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 75.34 111.053 179.804 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.7 33.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 65.42 110.869 179.993 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -128.45 27.73 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 74.54 111.159 179.859 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -114.79 13.7 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.486 . . . . 72.33 111.135 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.134 -0.485 . . . . 72.21 111.017 179.829 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.778 0.323 . . . . 74.25 110.831 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -59.76 -18.45 43.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.153 -0.476 . . . . 75.11 110.897 179.932 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.9 mt -102.24 0.92 35.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 75.55 110.913 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -112.25 -22.16 11.07 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.231 -0.44 . . . . 72.35 110.889 179.928 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.468 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -73.5 -60.86 1.55 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.575 0.702 . . . . 75.33 111.155 179.884 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.468 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.5 Cg_endo -69.72 -18.39 37.23 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.687 2.258 . . . . 71.14 112.375 179.905 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.57 7.98 19.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.267 -0.424 . . . . 73.41 110.962 179.911 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.1 -67.03 0.32 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 75.34 111.032 179.805 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.0 35.74 0.21 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.263 -0.426 . . . . 65.42 110.878 179.956 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -122.62 2.83 5.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 74.54 111.153 179.82 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.5 pt -66.09 -36.5 77.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 72.33 111.121 179.849 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 72.21 111.081 179.867 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 3.5 mtm180 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.788 0.328 . . . . 74.25 110.869 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.86 -2.23 57.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 75.11 110.875 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 19.0 mt -105.59 -19.46 13.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.254 -0.43 . . . . 75.55 110.94 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.4 pp -101.56 -20.48 15.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.204 -0.453 . . . . 72.35 110.904 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.531 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -69.91 -57.2 6.6 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.595 0.712 . . . . 75.33 111.142 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.75 -28.32 25.43 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.642 2.228 . . . . 71.14 112.353 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.9 mp -83.73 -23.85 31.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.246 -0.434 . . . . 73.41 110.934 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -51.89 -29.79 21.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 75.34 111.028 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -63.35 1.41 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 65.42 110.833 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.0 tp -51.34 -27.76 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 74.54 111.132 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.5 tp -55.2 -26.68 18.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.212 -0.449 . . . . 72.33 111.108 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -129.31 -0.85 5.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.21 111.079 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -90.08 4.47 50.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.265 -0.425 . . . . 71.11 110.825 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.9 pp -121.57 -10.25 9.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.235 -0.439 . . . . 75.2 111.145 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -94.9 -20.68 19.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 74.12 110.948 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.31 -33.51 12.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.07 -0.514 . . . . 75.33 110.903 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.5 pp -79.71 -32.51 14.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.165 -0.47 . . . . 74.43 111.106 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -105.08 -22.9 13.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 64.45 111.124 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 C-N-CA 120.67 -0.776 . . . . 54.33 112.512 -179.957 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.774 0.321 . . . . 74.25 110.85 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -18.7 46.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.202 -0.454 . . . . 75.11 110.894 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.86 -0.26 37.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 75.55 110.869 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -111.78 -24.06 10.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.197 -0.456 . . . . 72.35 110.969 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.491 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -69.5 -59.69 4.61 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 121.568 0.699 . . . . 75.33 111.143 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.1 Cg_endo -69.76 -23.62 30.6 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.668 2.245 . . . . 71.14 112.334 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.6 mp -89.51 -18.76 26.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.245 -0.434 . . . . 73.41 110.941 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -54.51 -26.01 29.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.161 -0.472 . . . . 75.34 111.058 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -74.06 -62.57 1.46 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 65.42 110.865 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.0 pt -61.66 -21.34 25.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.256 -0.429 . . . . 74.54 111.099 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.6 tp -52.21 -26.51 8.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.18 -0.464 . . . . 72.33 111.108 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -119.85 -31.54 4.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 72.21 111.097 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -51.89 -40.98 61.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.248 -0.433 . . . . 71.11 110.832 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.5 pt -68.69 -36.33 73.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 75.2 111.097 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.43 -16.62 59.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 74.12 110.869 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -89.41 -37.39 14.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 75.33 110.928 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 25.6 pt -84.6 -31.77 7.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 74.43 111.114 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -98.64 -21.99 16.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 64.45 111.082 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 C-N-CA 120.724 -0.75 . . . . 54.33 112.471 -179.953 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.6 mtm-85 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.804 0.335 . . . . 74.25 110.866 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 22.4 mtt -64.26 -14.52 56.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 75.11 110.885 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt -101.23 -10.72 20.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 75.55 110.916 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.5 mt -98.79 -25.69 14.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.149 -0.478 . . . . 72.35 110.922 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.485 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -67.44 -59.61 6.87 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.538 0.685 . . . . 75.33 111.058 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.485 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.78 -21.19 33.75 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.611 2.207 . . . . 71.14 112.388 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.3 tt -87.53 -17.29 32.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 73.41 110.941 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -88.74 15.06 8.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 75.34 111.1 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -144.08 14.84 1.69 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.135 -0.484 . . . . 65.42 110.889 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 pp -117.08 -23.57 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.271 -0.422 . . . . 74.54 111.197 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.86 -17.16 21.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 72.33 111.117 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -118.37 -22.83 7.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 72.21 111.135 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -79.88 -0.95 36.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.209 -0.45 . . . . 71.11 110.9 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.8 pp -106.59 -12.42 10.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 75.2 111.102 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.83 -9.78 57.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 74.12 110.911 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -113.21 -44.46 3.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.172 -0.467 . . . . 75.33 110.881 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.2 tp -69.08 -30.15 45.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 74.43 111.14 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -142.1 12.82 2.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.145 -0.479 . . . . 64.45 111.132 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 C-N-CA 120.727 -0.749 . . . . 54.33 112.543 -179.956 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.709 0.29 . . . . 74.25 110.828 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 mtt -59.91 -18.26 43.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 75.11 110.899 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.82 0.27 35.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 75.55 110.912 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.2 mt -112.11 -22.04 11.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.137 -0.483 . . . . 72.35 110.926 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.477 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -72.75 -60.49 1.94 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.62 0.724 . . . . 75.33 111.185 179.877 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.4 Cg_endo -69.83 -20.48 34.47 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.641 2.227 . . . . 71.14 112.296 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.1 mp -109.24 6.5 24.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 73.41 110.93 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.25 -52.4 16.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.446 . . . . 75.34 111.16 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.89 36.79 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 65.42 110.944 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -125.54 19.08 4.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 74.54 111.154 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.86 6.29 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 72.33 111.131 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -178.67 32.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 72.21 111.098 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -122.26 -33.91 3.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 71.11 110.88 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -114.19 -20.39 6.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.251 -0.431 . . . . 75.2 111.104 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -89.5 -8.31 53.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.141 -0.482 . . . . 74.12 110.9 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -106.74 -41.09 5.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.142 -0.481 . . . . 75.33 110.873 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.2 tp -73.0 -30.92 33.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.169 -0.468 . . . . 74.43 111.11 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.67 -20.06 9.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.178 -0.465 . . . . 64.45 111.139 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 C-N-CA 120.768 -0.73 . . . . 54.33 112.481 -179.98 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.526 0.055 0 CA-C-O 120.728 0.299 . . . . 74.25 110.835 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.5 ttt -72.98 -8.27 54.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 75.11 110.916 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 30.6 tp -102.67 -19.86 14.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.227 -0.442 . . . . 75.55 110.858 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -93.79 -23.84 18.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 72.35 110.85 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.521 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -67.89 -57.93 8.83 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.63 0.729 . . . . 75.33 111.164 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.521 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.67 -25.49 28.97 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.722 2.281 . . . . 71.14 112.36 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -88.17 -19.6 26.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 73.41 110.964 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -54.54 -26.43 31.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.466 . . . . 75.34 111.099 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -107.56 -30.23 8.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.435 . . . . 65.42 110.892 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.7 tp -54.93 -25.04 15.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 74.54 111.152 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.6 pt -64.97 -15.12 17.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.48 . . . . 72.33 111.071 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -119.41 -26.41 5.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 72.21 111.123 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 63.0 m170 -57.8 -23.92 54.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 71.11 110.91 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.9 pp -118.61 -12.82 10.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.192 -0.458 . . . . 75.2 111.049 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.6 ttt-85 -92.13 -17.45 24.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 74.12 110.839 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -104.74 -37.01 7.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.238 -0.437 . . . . 75.33 110.924 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.1 tp -70.46 -30.01 41.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.156 -0.475 . . . . 74.43 111.132 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -117.75 -16.35 10.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 64.45 111.077 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 C-N-CA 120.731 -0.747 . . . . 54.33 112.46 -179.962 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.769 0.318 . . . . 74.25 110.856 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -63.78 -15.86 59.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 75.11 110.903 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.85 -4.29 25.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 75.55 110.907 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 16.5 mt -106.6 -24.62 12.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 72.35 110.958 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.526 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -70.0 -57.79 5.9 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 121.548 0.69 . . . . 75.33 111.116 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.75 -19.9 35.57 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.717 2.278 . . . . 71.14 112.291 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.0 mp -89.56 -19.95 24.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.258 -0.428 . . . . 73.41 110.933 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.64 16.55 11.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.449 . . . . 75.34 111.061 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.09 -32.35 3.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 65.42 110.945 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.9 pt -72.04 -35.15 52.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 74.54 111.135 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.7 pt -59.8 -19.19 16.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 72.33 111.158 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -117.36 -15.56 10.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.17 -0.468 . . . . 72.21 111.133 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -68.7 -24.55 64.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 71.11 110.78 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.9 pp -121.42 0.84 6.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.249 -0.432 . . . . 75.2 111.077 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -101.78 -19.79 15.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.184 -0.462 . . . . 74.12 110.798 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.6 -32.17 7.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 75.33 110.968 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.0 tp -72.18 -30.02 34.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.06 -0.518 . . . . 74.43 111.107 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -117.26 -18.46 9.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 64.45 111.132 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.281 0 C-N-CA 120.682 -0.771 . . . . 54.33 112.494 -179.987 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.2 mpp_? . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.868 0.366 . . . . 74.25 110.86 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.2 ptp -72.51 -8.64 56.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 75.11 110.917 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.9 -19.66 14.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.446 . . . . 75.55 110.94 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -92.62 -24.59 18.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 72.35 110.928 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.527 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -67.85 -57.79 9.13 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.535 0.683 . . . . 75.33 111.103 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.71 -23.44 31.03 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.669 2.246 . . . . 71.14 112.335 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.99 -20.6 30.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 73.41 110.933 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -89.25 11.96 17.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 75.34 111.107 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.6 mmmt -136.94 9.34 3.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 65.42 110.928 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.8 pp -117.51 -18.64 6.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 74.54 111.158 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.92 -16.15 15.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.149 -0.478 . . . . 72.33 111.104 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -124.43 -34.81 2.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.243 -0.435 . . . . 72.21 111.094 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -50.35 -37.07 35.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 71.11 110.852 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.8 pt -67.01 -36.41 77.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 75.2 111.183 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.94 -19.16 48.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.475 . . . . 74.12 110.864 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -90.01 -33.4 16.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.202 -0.454 . . . . 75.33 110.881 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.3 pp -86.25 -32.06 6.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 74.43 111.154 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -96.73 -23.31 16.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.464 . . . . 64.45 111.125 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.255 0 C-N-CA 120.668 -0.777 . . . . 54.33 112.474 179.972 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.878 0.371 . . . . 74.25 110.874 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.23 -15.92 50.12 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.201 -0.454 . . . . 75.11 110.941 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.38 -6.63 22.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 75.55 110.926 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 15.9 mt -103.16 -21.81 13.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 72.35 110.909 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.461 ' CB ' ' CD ' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -73.05 -60.97 1.64 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.64 0.733 . . . . 75.33 111.199 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.81 -17.08 37.57 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.692 2.261 . . . . 71.14 112.336 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -112.43 5.61 18.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 73.41 110.94 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.03 -55.13 8.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 75.34 111.113 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.96 31.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.24 -0.436 . . . . 65.42 110.879 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -114.04 11.46 8.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.249 -0.432 . . . . 74.54 111.1 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.95 4.8 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.474 . . . . 72.33 111.134 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -153.63 19.07 0.54 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.467 . . . . 72.21 111.117 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 -123.76 -36.4 2.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 71.11 110.868 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.5 pt -68.32 -36.41 74.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 75.2 111.149 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.35 -16.5 59.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.186 -0.461 . . . . 74.12 110.84 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -90.43 -35.62 15.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 75.33 110.899 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 25.5 pt -85.73 -31.74 6.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.121 -0.49 . . . . 74.43 111.087 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -97.09 -22.08 16.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.246 -0.434 . . . . 64.45 111.089 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.231 0 C-N-CA 120.757 -0.735 . . . . 54.33 112.457 -179.98 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.815 0.34 . . . . 74.25 110.891 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.8 mtt -80.3 -1.32 40.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.218 -0.446 . . . . 75.11 110.874 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 39.7 tp -105.2 -26.72 11.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 75.55 110.928 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 pp -90.33 -22.92 21.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 72.35 110.921 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.519 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.01 -58.02 8.5 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.589 0.709 . . . . 75.33 111.145 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.7 Cg_endo -69.77 -25.53 28.47 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.643 2.228 . . . . 71.14 112.363 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -87.56 -21.23 25.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 73.41 110.947 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -52.81 -28.29 21.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 75.34 111.106 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.25 -31.82 8.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 65.42 110.888 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.55 -26.42 9.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 74.54 111.177 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.6 pt -65.96 -34.08 67.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 72.33 111.104 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -97.78 -14.84 20.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.227 -0.442 . . . . 72.21 111.07 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -75.67 -43.0 49.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 71.11 110.866 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.5 pt -66.3 -36.56 77.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 75.2 111.147 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.3 ptt85 -80.14 -14.26 58.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 74.12 110.909 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -97.76 -26.53 14.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.136 -0.484 . . . . 75.33 110.895 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.5 pp -90.27 -33.44 5.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.112 -0.494 . . . . 74.43 111.126 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.3 19.46 11.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 64.45 111.111 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.268 0 C-N-CA 120.68 -0.772 . . . . 54.33 112.477 -179.929 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.133 0 CA-C-O 120.78 0.324 . . . . 74.25 110.925 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.7 ttp -64.8 -13.93 57.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 75.11 110.929 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 41.3 tp -100.6 -13.42 18.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 75.55 110.916 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -96.61 -25.09 15.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.152 -0.476 . . . . 72.35 110.873 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.483 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -66.99 -59.62 7.36 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 121.52 0.676 . . . . 75.33 111.178 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.5 Cg_endo -69.79 -22.53 31.79 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.72 2.28 . . . . 71.14 112.327 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -90.62 -17.04 27.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 73.41 110.923 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.49 -19.95 51.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 75.34 111.057 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.3 mptt -119.77 -27.1 5.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.248 -0.433 . . . . 65.42 110.856 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.7 tp -54.45 -27.23 17.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.281 -0.418 . . . . 74.54 111.119 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -62.64 -16.13 16.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 72.33 111.142 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -124.31 -16.93 6.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.167 -0.47 . . . . 72.21 111.161 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -54.24 -37.53 64.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.2 -0.454 . . . . 71.11 110.883 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -116.22 4.45 7.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 75.2 111.166 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.2 ttp85 -108.38 -11.99 15.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.468 . . . . 74.12 110.918 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -113.09 -33.7 5.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.47 . . . . 75.33 110.915 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.3 tp -73.49 -31.39 32.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 74.43 111.06 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.7 -21.24 9.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.161 -0.472 . . . . 64.45 111.165 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.375 0 C-N-CA 120.743 -0.742 . . . . 54.33 112.554 -179.963 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.775 0.322 . . . . 74.25 110.872 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -11.04 60.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 75.11 110.867 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.48 -14.7 16.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 75.55 111.006 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.43 -26.03 15.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 72.35 110.902 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.512 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -66.93 -57.79 10.71 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.572 0.701 . . . . 75.33 111.179 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.79 -24.37 29.6 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.719 2.28 . . . . 71.14 112.341 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.8 tt -89.14 -17.96 28.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.21 -0.45 . . . . 73.41 110.89 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.61 -20.28 54.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 75.34 111.069 179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -119.23 -26.69 5.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 65.42 110.948 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.7 tp -54.73 -26.14 16.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 74.54 111.105 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.78 -14.49 15.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 72.33 111.11 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -120.94 -26.81 5.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 72.21 111.074 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 50.7 t-80 -57.08 -23.83 49.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 71.11 110.811 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.9 pp -117.44 -18.57 6.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.434 . . . . 75.2 111.145 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -92.14 -1.97 56.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.463 . . . . 74.12 110.856 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -111.97 -41.16 4.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.245 -0.434 . . . . 75.33 110.838 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.5 pp -75.09 -30.63 23.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 74.43 111.127 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.85 -22.45 8.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 64.45 111.043 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.741 -0.742 . . . . 54.33 112.536 -179.938 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 120.776 0.322 . . . . 74.25 110.877 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.26 -1.35 40.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.473 . . . . 75.11 110.96 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.14 -26.67 11.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 75.55 110.96 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 pp -90.3 -22.9 21.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 72.35 110.94 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.516 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.02 -58.0 8.5 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.655 0.74 . . . . 75.33 111.146 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.74 -25.53 28.58 Favored 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.742 2.295 . . . . 71.14 112.353 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.5 tt -86.45 -19.09 30.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.231 -0.44 . . . . 73.41 110.947 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.56 -16.75 57.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.461 . . . . 75.34 111.066 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.4 pttt -114.37 -24.39 8.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.211 -0.45 . . . . 65.42 110.891 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.5 tp -58.37 -21.54 18.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.243 -0.435 . . . . 74.54 111.111 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -103.14 4.74 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.466 . . . . 72.33 111.12 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -136.15 14.68 3.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 72.21 111.087 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -121.61 -34.25 3.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.243 -0.435 . . . . 71.11 110.841 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.9 pp -118.25 -14.24 9.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.236 -0.438 . . . . 75.2 111.044 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.1 ttt-85 -95.65 -12.06 26.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 74.12 110.91 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -105.85 -37.02 6.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 75.33 110.851 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.3 tp -75.31 -30.87 23.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.135 -0.484 . . . . 74.43 111.114 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.66 -22.81 8.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.242 -0.435 . . . . 64.45 111.093 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 C-N-CA 120.726 -0.75 . . . . 54.33 112.432 -179.872 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.775 0.321 . . . . 74.25 110.921 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.8 ttm -72.96 -8.33 55.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 75.11 110.882 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.74 -19.42 14.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 75.55 110.933 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 13.4 mt -94.77 -23.13 17.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.247 -0.433 . . . . 72.35 110.917 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.514 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.51 -57.88 7.89 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 121.599 0.714 . . . . 75.33 111.184 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.4 Cg_endo -69.85 -25.84 27.77 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.7 2.267 . . . . 71.14 112.307 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.2 tp -88.85 -18.48 27.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 73.41 110.946 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -51.32 -30.56 18.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.18 -0.464 . . . . 75.34 111.133 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -62.88 1.5 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 65.42 110.918 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.51 -26.14 9.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.269 -0.423 . . . . 74.54 111.12 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.7 tp -52.53 -26.25 9.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 72.33 111.101 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -115.65 -29.14 6.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 72.21 111.156 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -51.98 -35.94 48.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 71.11 110.86 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.5 pt -71.22 -35.23 57.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 75.2 111.131 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.5 mmt180 -77.54 -9.15 58.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.092 -0.504 . . . . 74.12 110.908 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -106.06 -40.83 5.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 75.33 110.938 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.0 tp -71.86 -29.87 35.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 74.43 111.133 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.98 -17.7 10.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 64.45 111.141 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 C-N-CA 120.76 -0.733 . . . . 54.33 112.487 -179.97 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.815 0.341 . . . . 74.25 110.868 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -64.14 -14.79 57.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 75.11 110.879 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 mt -101.57 -9.72 20.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.194 -0.457 . . . . 75.55 110.923 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 21.6 mt -99.63 -25.43 14.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.175 -0.466 . . . . 72.35 110.917 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.494 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -68.33 -59.5 5.99 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.573 0.702 . . . . 75.33 111.162 179.96 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.7 -20.47 35.07 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.746 2.297 . . . . 71.14 112.356 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 28.1 tp -87.11 -21.06 26.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.223 -0.444 . . . . 73.41 110.977 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -90.88 43.75 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 75.34 111.089 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -168.62 -42.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 65.42 110.855 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.7 tp -55.01 -27.13 18.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.269 -0.423 . . . . 74.54 111.153 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -15.42 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 72.33 111.046 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -133.24 1.02 3.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 72.21 111.076 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -80.27 -31.07 38.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.44 . . . . 71.11 110.883 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.17 -18.83 17.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.242 -0.436 . . . . 75.2 111.14 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -95.41 -9.24 33.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 74.12 110.831 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -110.51 -32.93 6.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 75.33 110.838 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 10.6 tp -79.55 -28.77 13.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 74.43 111.114 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.76 -25.56 7.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 64.45 111.161 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 C-N-CA 120.655 -0.783 . . . . 54.33 112.48 -179.993 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.7 ttt180 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.762 0.315 . . . . 74.25 110.876 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -72.6 -8.63 56.23 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.231 -0.44 . . . . 75.11 110.859 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 11.4 mt -102.75 -19.53 14.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.235 -0.439 . . . . 75.55 110.939 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -93.37 -24.27 18.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.197 -0.456 . . . . 72.35 110.902 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.514 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -67.83 -57.87 9.02 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.582 0.706 . . . . 75.33 111.116 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.73 -23.96 30.33 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.705 2.27 . . . . 71.14 112.368 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -84.45 -24.55 29.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.454 . . . . 73.41 110.909 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.91 -18.31 60.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 75.34 111.117 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -92.6 -2.11 56.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 65.42 110.924 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 pp -128.0 -1.38 3.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 74.54 111.208 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.2 tp -79.78 -26.55 12.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.12 -0.491 . . . . 72.33 111.068 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -168.04 28.69 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 72.21 111.149 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -113.98 -9.64 12.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 71.11 110.847 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -131.56 4.39 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.204 -0.453 . . . . 75.2 111.081 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -106.37 -18.14 14.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.196 -0.456 . . . . 74.12 110.907 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -112.21 -29.13 7.68 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.235 -0.439 . . . . 75.33 110.844 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 10.8 tp -73.93 -29.77 26.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.129 -0.487 . . . . 74.43 111.151 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.97 -20.33 9.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 64.45 111.092 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 C-N-CA 120.733 -0.746 . . . . 54.33 112.461 -179.955 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.75 0.31 . . . . 74.25 110.813 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -81.11 -0.7 41.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 75.11 110.83 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.5 mt -105.56 -26.88 11.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.445 . . . . 75.55 110.921 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 pp -90.61 -22.74 21.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 72.35 110.969 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.522 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.31 -58.0 8.04 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.58 0.705 . . . . 75.33 111.1 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.522 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.4 Cg_endo -69.74 -25.54 28.57 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.762 2.308 . . . . 71.14 112.347 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.67 -21.68 25.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 73.41 110.985 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -51.41 -30.54 19.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 75.34 111.092 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -76.23 -59.78 2.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 65.42 111.0 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.53 -26.16 9.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 74.54 111.196 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.7 tp -52.5 -26.19 9.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 72.33 111.169 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -116.77 -27.38 6.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.154 -0.476 . . . . 72.21 111.091 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -54.03 -37.83 64.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 71.11 110.847 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.6 pt -72.63 -34.84 48.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.447 . . . . 75.2 111.186 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -76.56 -17.6 59.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.098 -0.501 . . . . 74.12 110.865 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -98.48 -37.24 9.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 75.33 110.911 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 10.9 tp -74.72 -29.61 23.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.146 -0.479 . . . . 74.43 111.148 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -109.47 -14.06 14.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.149 -0.478 . . . . 64.45 111.117 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 C-N-CA 120.766 -0.73 . . . . 54.33 112.467 -179.94 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.739 0.305 . . . . 74.25 110.858 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.2 ttm -66.88 -13.42 61.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.453 . . . . 75.11 110.869 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.41 -9.2 20.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.294 -0.412 . . . . 75.55 110.841 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -103.86 -23.57 13.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.212 -0.449 . . . . 72.35 110.942 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.523 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -69.16 -57.57 7.24 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.594 0.711 . . . . 75.33 111.123 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.523 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.81 -24.64 29.22 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.703 2.269 . . . . 71.14 112.282 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -82.05 -29.41 31.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.249 -0.432 . . . . 73.41 110.959 179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.13 58.73 1.61 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 75.34 111.115 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -178.7 -49.31 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.248 -0.433 . . . . 65.42 110.915 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.4 pt -64.43 -13.5 14.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 74.54 111.155 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.0 pt -58.33 -19.27 13.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 72.33 111.152 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -150.15 -37.49 0.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.449 . . . . 72.21 111.129 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 80.7 t60 -48.23 -36.93 14.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.239 -0.437 . . . . 71.11 110.858 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.9 pp -116.94 -4.09 10.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 75.2 111.15 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.47 -7.3 26.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 74.12 110.895 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.85 -42.11 3.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 75.33 110.865 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 35.0 pt -69.43 -29.99 43.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.2 -0.455 . . . . 74.43 111.118 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -145.43 15.01 1.45 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.459 . . . . 64.45 111.116 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 C-N-CA 120.757 -0.735 . . . . 54.33 112.502 -179.989 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.782 0.325 . . . . 74.25 110.9 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 33.1 ttm -70.03 -10.74 59.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 75.11 110.846 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 48.9 mt -102.65 -15.49 16.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 75.55 110.914 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.89 -26.51 16.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.175 -0.466 . . . . 72.35 110.955 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.516 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -66.8 -57.66 11.23 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.548 0.69 . . . . 75.33 111.121 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.79 -22.95 31.24 Favored 'Trans proline' 0 N--CA 1.464 -0.232 0 C-N-CA 122.691 2.261 . . . . 71.14 112.386 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.6 tt -85.78 -21.55 28.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 73.41 110.915 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -83.52 3.98 29.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.233 -0.439 . . . . 75.34 111.088 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.56 -37.7 5.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 65.42 110.889 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.3 pt -67.65 -28.41 41.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 74.54 111.118 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.7 pt -87.47 43.14 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.208 -0.451 . . . . 72.33 111.134 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 179.61 -33.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 72.21 111.064 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.01 -11.62 60.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.259 -0.428 . . . . 71.11 110.837 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.8 pp -108.05 -14.64 9.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 75.2 111.106 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -94.98 2.06 55.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.455 . . . . 74.12 110.828 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -120.91 -39.94 2.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 75.33 110.869 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.2 tp -71.93 -31.09 39.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 74.43 111.144 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -152.45 19.85 0.63 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.195 -0.457 . . . . 64.45 111.171 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.784 -0.722 . . . . 54.33 112.485 179.99 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.872 0.368 . . . . 74.25 110.887 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.5 ptt? -85.73 -1.39 57.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.445 . . . . 75.11 110.884 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 84.6 mt -106.46 -20.29 13.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.243 -0.435 . . . . 75.55 110.888 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.5 pp -99.89 -21.04 15.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.235 -0.438 . . . . 72.35 110.943 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.525 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -70.05 -57.2 6.41 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.553 0.692 . . . . 75.33 111.155 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.72 -26.79 27.41 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.681 2.254 . . . . 71.14 112.354 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -80.68 -24.05 39.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 73.41 110.961 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -81.52 0.18 39.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.45 . . . . 75.34 111.052 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.22 2.08 13.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.291 -0.413 . . . . 65.42 110.907 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 pp -121.43 -10.62 9.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 74.54 111.174 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.7 pp -63.04 -15.65 16.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.142 -0.481 . . . . 72.33 111.159 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -137.27 -41.89 0.57 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 72.21 111.088 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -60.04 -43.17 95.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 71.11 110.89 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.5 tp -68.66 -26.34 32.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 75.2 111.15 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -87.21 -10.65 52.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 74.12 110.872 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -104.16 -38.6 6.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.195 -0.457 . . . . 75.33 110.891 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 10.8 tp -76.45 -29.33 18.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 74.43 111.128 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.07 -21.4 10.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 64.45 111.1 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 C-N-CA 120.755 -0.736 . . . . 54.33 112.462 -179.983 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.792 0.33 . . . . 74.25 110.855 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.2 mtt -60.78 -18.09 53.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 75.11 110.938 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.4 mt -101.43 -0.73 34.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 75.55 110.856 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.93 -25.92 10.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.242 -0.436 . . . . 72.35 110.879 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.479 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -68.61 -59.58 5.59 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 121.592 0.711 . . . . 75.33 111.175 179.92 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.74 -21.68 33.24 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.722 2.281 . . . . 71.14 112.366 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -86.62 -21.58 26.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 73.41 110.896 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.99 58.02 1.44 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 75.34 111.094 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -166.15 -48.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 65.42 110.869 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -88.89 -1.4 8.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 74.54 111.107 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.8 pp -91.39 14.35 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 72.33 111.141 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -154.05 -45.74 0.09 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 72.21 111.087 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 45.6 t60 -58.31 -36.21 73.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.219 -0.446 . . . . 71.11 110.917 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.5 tp -69.27 -26.19 31.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.446 . . . . 75.2 111.126 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -87.17 -10.49 52.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.466 . . . . 74.12 110.813 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.6 -39.02 6.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 75.33 110.903 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 10.9 tp -75.55 -29.48 20.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 74.43 111.082 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.5 -20.92 10.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 64.45 111.05 179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 C-N-CA 120.745 -0.741 . . . . 54.33 112.432 -179.877 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.094 0 CA-C-O 120.812 0.339 . . . . 74.25 110.841 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 mtm -67.83 -12.73 61.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.167 -0.47 . . . . 75.11 110.86 179.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.2 mt -104.13 -6.69 20.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.28 -0.418 . . . . 75.55 110.901 -179.975 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 13.2 mt -108.17 -20.51 13.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 72.35 110.922 179.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.512 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -73.16 -58.33 2.52 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.544 0.688 . . . . 75.33 111.184 179.91 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.3 Cg_endo -69.73 -23.71 30.63 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.711 2.274 . . . . 71.14 112.387 179.873 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.8 mp -107.16 6.63 28.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 73.41 110.915 179.993 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -46.67 -53.24 12.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.471 . . . . 75.34 111.137 179.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.46 36.23 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.465 . . . . 65.42 110.917 179.997 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -125.16 18.95 4.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 74.54 111.122 179.851 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.53 6.19 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.19 -0.459 . . . . 72.33 111.134 179.851 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -178.49 32.06 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.493 . . . . 72.21 111.16 179.796 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -122.73 -32.37 3.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.467 . . . . 71.11 110.856 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.9 pp -118.72 -12.54 10.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 75.2 111.152 -179.99 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.53 -18.99 21.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.487 . . . . 74.12 110.822 -179.975 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -103.5 -34.48 8.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.26 -0.427 . . . . 75.33 110.862 -179.964 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 10.9 tp -73.2 -29.78 29.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.455 . . . . 74.43 111.141 179.977 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.74 -18.9 10.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 64.45 111.077 179.807 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 C-N-CA 120.747 -0.74 . . . . 54.33 112.461 -179.911 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.825 0.345 . . . . 74.25 110.934 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 27.7 mtm -64.16 -15.68 60.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 75.11 110.873 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.07 -4.96 25.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.231 -0.44 . . . . 75.55 110.916 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -108.22 -23.56 11.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 72.35 110.82 179.962 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.519 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -69.69 -57.93 6.15 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.672 0.749 . . . . 75.33 111.146 179.988 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.1 Cg_endo -69.73 -25.41 28.78 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.65 2.234 . . . . 71.14 112.379 179.913 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -85.6 -21.73 28.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 73.41 110.881 -179.982 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.14 -20.72 64.39 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.169 -0.468 . . . . 75.34 111.08 179.825 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.0 -29.26 11.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 65.42 110.906 179.976 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.22 -26.98 9.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.221 -0.445 . . . . 74.54 111.146 179.816 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.6 pt -67.02 -35.71 75.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 72.33 111.141 179.901 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.42 -46.09 20.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 72.21 111.101 179.812 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -55.78 -43.23 76.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 71.11 110.886 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.2 tp -57.79 -26.87 29.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 75.2 111.099 179.994 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -89.61 -10.12 47.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.447 . . . . 74.12 110.922 179.878 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -100.72 -30.32 11.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 75.33 110.861 -179.883 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 24.3 pt -89.29 -31.77 5.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.169 -0.469 . . . . 74.43 111.158 179.955 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.75 -21.95 19.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 64.45 111.116 179.798 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.293 0 C-N-CA 120.699 -0.763 . . . . 54.33 112.481 -179.928 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 10.7 ttt180 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.789 0.328 . . . . 74.25 110.869 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -84.17 4.64 29.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 75.11 110.931 179.968 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.77 -5.94 13.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.48 . . . . 75.55 110.933 -179.971 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -110.57 -23.94 10.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 72.35 110.951 179.897 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.481 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -68.34 -59.5 5.98 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.547 0.689 . . . . 75.33 111.174 179.896 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.2 Cg_endo -69.78 -25.91 28.02 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.695 2.263 . . . . 71.14 112.387 179.902 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.1 tt -87.13 -19.33 28.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 73.41 110.973 179.902 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -52.43 -28.4 19.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 75.34 111.118 179.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -106.6 -32.25 8.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 65.42 110.908 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.0 tp -52.06 -26.47 8.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 74.54 111.208 179.839 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.7 pt -65.37 -36.03 76.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.114 -0.494 . . . . 72.33 111.189 179.781 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -89.03 -28.3 20.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.189 -0.46 . . . . 72.21 111.078 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.07 -36.18 79.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.309 -0.405 . . . . 71.11 110.843 179.96 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.7 tp -65.08 -26.55 40.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 75.2 111.206 179.953 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -86.79 -9.92 54.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.088 -0.505 . . . . 74.12 110.893 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -103.54 -39.24 6.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.125 -0.489 . . . . 75.33 110.905 -179.917 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.4 tp -75.96 -31.05 21.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 74.43 111.138 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -112.66 -21.63 11.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.154 -0.475 . . . . 64.45 111.134 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.36 0 C-N-CA 120.73 -0.747 . . . . 54.33 112.476 -179.935 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.771 0.319 . . . . 74.25 110.862 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.4 ttm -77.37 -4.38 44.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.449 . . . . 75.11 110.853 179.946 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 41.5 tp -107.69 -11.72 15.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.439 . . . . 75.55 110.957 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -106.86 -20.14 13.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.204 -0.453 . . . . 72.35 110.899 179.905 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.525 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -73.17 -57.92 2.67 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.596 0.713 . . . . 75.33 111.14 179.943 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.84 -23.88 29.95 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.634 2.222 . . . . 71.14 112.34 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.3 mp -106.51 5.87 29.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.454 . . . . 73.41 110.951 179.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.73 -51.92 20.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 75.34 111.053 179.804 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.7 33.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 65.42 110.869 179.993 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -128.45 27.73 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 74.54 111.159 179.859 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -114.79 13.7 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.486 . . . . 72.33 111.135 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -178.86 -34.0 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.134 -0.485 . . . . 72.21 111.017 179.829 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 17.6 t60 -59.86 -19.09 49.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.267 -0.424 . . . . 71.11 110.774 -179.92 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -125.99 4.66 4.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 75.2 111.13 -179.935 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.58 -17.86 14.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.174 -0.466 . . . . 74.12 110.913 179.966 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -111.97 -29.48 7.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.473 . . . . 75.33 110.857 -179.894 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 10.8 tp -74.17 -29.67 25.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 74.43 111.171 179.967 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -117.02 -20.46 9.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.113 -0.494 . . . . 64.45 111.065 179.832 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 C-N-CA 120.713 -0.756 . . . . 54.33 112.484 -179.973 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.778 0.323 . . . . 74.25 110.831 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -59.76 -18.45 43.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.153 -0.476 . . . . 75.11 110.897 179.932 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.9 mt -102.24 0.92 35.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 75.55 110.913 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -112.25 -22.16 11.07 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.231 -0.44 . . . . 72.35 110.889 179.928 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.468 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -73.5 -60.86 1.55 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.575 0.702 . . . . 75.33 111.155 179.884 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.468 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.5 Cg_endo -69.72 -18.39 37.23 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.687 2.258 . . . . 71.14 112.375 179.905 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.57 7.98 19.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.267 -0.424 . . . . 73.41 110.962 179.911 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.1 -67.03 0.32 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 75.34 111.032 179.805 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.0 35.74 0.21 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.263 -0.426 . . . . 65.42 110.878 179.956 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -122.62 2.83 5.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 74.54 111.153 179.82 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.5 pt -66.09 -36.5 77.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 72.33 111.121 179.849 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -137.83 -39.05 0.56 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 72.21 111.081 179.867 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -57.34 -33.52 67.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 71.11 110.825 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.3 tp -57.79 -26.81 28.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 75.2 111.162 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 -89.68 -10.23 46.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 74.12 110.879 179.949 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -100.66 -30.17 11.9 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.16 -0.473 . . . . 75.33 110.908 -179.958 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 24.5 pt -89.32 -31.68 5.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.172 -0.467 . . . . 74.43 111.126 179.951 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.12 -22.02 19.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.436 . . . . 64.45 111.102 179.766 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.235 0 C-N-CA 120.771 -0.728 . . . . 54.33 112.439 -179.951 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.656 ' HG2' HD11 ' A' ' 4' ' ' LEU . 3.5 mtm180 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.788 0.328 . . . . 74.21 110.869 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.86 -2.23 57.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 74.43 110.875 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.493 ' O ' HD22 ' A' ' 7' ' ' LEU . 19.0 mt -105.59 -19.46 13.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.254 -0.43 . . . . 74.2 110.94 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.656 HD11 ' HG2' ' A' ' 1' ' ' ARG . 3.4 pp -101.56 -20.48 15.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.204 -0.453 . . . . 62.44 110.904 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.539 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -69.91 -57.2 6.6 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.595 0.712 . . . . 75.33 111.142 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.539 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.75 -28.32 25.43 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.642 2.228 . . . . 64.41 112.353 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.493 HD22 ' O ' ' A' ' 3' ' ' LEU . 9.9 mp -83.73 -23.85 31.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.246 -0.434 . . . . 72.14 110.934 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.528 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -51.89 -29.79 21.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 74.44 111.028 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -63.35 1.41 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 54.43 110.833 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.0 tp -51.34 -27.76 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 53.45 111.132 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.451 HG22 ' O ' ' A' ' 8' ' ' ALA . 2.5 tp -55.2 -26.68 18.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.212 -0.449 . . . . 72.33 111.108 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.21 111.079 179.768 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.774 0.321 . . . . 74.21 110.85 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -18.7 46.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.202 -0.454 . . . . 74.43 110.894 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.614 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -100.86 -0.26 37.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 74.2 110.869 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.557 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.2 mm? -111.78 -24.06 10.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.197 -0.456 . . . . 62.44 110.969 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.503 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -69.5 -59.69 4.61 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 121.568 0.699 . . . . 75.33 111.143 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.1 Cg_endo -69.76 -23.62 30.6 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.668 2.245 . . . . 64.41 112.334 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.614 HD13 ' O ' ' A' ' 3' ' ' LEU . 8.6 mp -89.51 -18.76 26.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.245 -0.434 . . . . 72.14 110.941 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.557 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -54.51 -26.01 29.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.161 -0.472 . . . . 74.44 111.058 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -74.06 -62.57 1.46 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 54.43 110.865 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.0 pt -61.66 -21.34 25.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.256 -0.429 . . . . 53.45 111.099 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.461 HG22 ' O ' ' A' ' 8' ' ' ALA . 2.6 tp -52.21 -26.51 8.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.18 -0.464 . . . . 72.33 111.108 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 72.21 111.097 179.816 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.6 mtm-85 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.804 0.335 . . . . 74.21 110.866 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 22.4 mtt -64.26 -14.52 56.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 74.43 110.885 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt -101.23 -10.72 20.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 74.2 110.916 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.5 mt -98.79 -25.69 14.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.149 -0.478 . . . . 62.44 110.922 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.495 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -67.44 -59.61 6.87 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.538 0.685 . . . . 75.33 111.058 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.553 ' O ' HG23 ' A' ' 10' ' ' ILE . 53.8 Cg_endo -69.78 -21.19 33.75 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.611 2.207 . . . . 64.41 112.388 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.3 tt -87.53 -17.29 32.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 72.14 110.941 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -88.74 15.06 8.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 74.44 111.1 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -144.08 14.84 1.69 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.135 -0.484 . . . . 54.43 110.889 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.553 HG23 ' O ' ' A' ' 6' ' ' PRO . 2.9 pp -117.08 -23.57 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.271 -0.422 . . . . 53.45 111.197 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.531 ' N ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -65.86 -17.16 21.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 72.33 111.117 179.861 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 72.21 111.135 179.735 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.709 0.29 . . . . 74.21 110.828 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 mtt -59.91 -18.26 43.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 74.43 110.899 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.551 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -101.82 0.27 35.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 74.2 110.912 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 11.2 mt -112.11 -22.04 11.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.137 -0.483 . . . . 62.44 110.926 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.489 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -72.75 -60.49 1.94 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.62 0.724 . . . . 75.33 111.185 179.877 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.734 ' HG2' HD12 ' A' ' 7' ' ' LEU . 53.4 Cg_endo -69.83 -20.48 34.47 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.641 2.227 . . . . 64.41 112.296 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.734 HD12 ' HG2' ' A' ' 6' ' ' PRO . 4.1 mp -109.24 6.5 24.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 72.14 110.93 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -47.25 -52.4 16.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.446 . . . . 74.44 111.16 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.677 ' H ' HD13 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -179.89 36.79 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 54.43 110.944 179.957 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.677 HD13 ' H ' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -125.54 19.08 4.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 53.45 111.154 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.507 ' H ' HD13 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -135.86 6.29 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 72.33 111.131 179.835 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 72.21 111.098 179.807 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.526 0.055 0 CA-C-O 120.728 0.299 . . . . 74.21 110.835 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.5 ttt -72.98 -8.27 54.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 74.43 110.916 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 30.6 tp -102.67 -19.86 14.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.227 -0.442 . . . . 74.2 110.858 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.528 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.2 mm? -93.79 -23.84 18.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 62.44 110.85 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.531 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -67.89 -57.93 8.83 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.63 0.729 . . . . 75.33 111.164 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.67 -25.49 28.97 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.722 2.281 . . . . 64.41 112.36 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.498 ' HG ' HG22 ' A' ' 10' ' ' ILE . 0.9 OUTLIER -88.17 -19.6 26.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 72.14 110.964 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.528 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -54.54 -26.43 31.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.466 . . . . 74.44 111.099 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -107.56 -30.23 8.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.435 . . . . 54.43 110.892 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.498 HG22 ' HG ' ' A' ' 7' ' ' LEU . 2.7 tp -54.93 -25.04 15.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 53.45 111.152 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.6 pt -64.97 -15.12 17.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.48 . . . . 72.33 111.071 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 72.21 111.123 179.791 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.769 0.318 . . . . 74.21 110.856 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -63.78 -15.86 59.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 74.43 110.903 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.559 ' O ' HD22 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -102.85 -4.29 25.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 74.2 110.907 -179.941 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 16.5 mt -106.6 -24.62 12.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 62.44 110.958 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.537 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -70.0 -57.79 5.9 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 121.548 0.69 . . . . 75.33 111.116 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.75 -19.9 35.57 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.717 2.278 . . . . 64.41 112.291 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.559 HD22 ' O ' ' A' ' 3' ' ' LEU . 11.0 mp -89.56 -19.95 24.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.258 -0.428 . . . . 72.14 110.933 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.64 16.55 11.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.449 . . . . 74.44 111.061 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.09 -32.35 3.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 54.43 110.945 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.9 pt -72.04 -35.15 52.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 53.45 111.135 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.7 pt -59.8 -19.19 16.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 72.33 111.158 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.17 -0.468 . . . . 72.21 111.133 179.785 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.2 mpp_? . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.868 0.366 . . . . 74.21 110.86 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.2 ptp -72.51 -8.64 56.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 74.43 110.917 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.9 -19.66 14.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.446 . . . . 74.2 110.94 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -92.62 -24.59 18.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 62.44 110.928 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.54 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -67.85 -57.79 9.13 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.535 0.683 . . . . 75.33 111.103 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.71 -23.44 31.03 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.669 2.246 . . . . 64.41 112.335 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.538 ' O ' HG23 ' A' ' 11' ' ' ILE . 0.7 OUTLIER -84.99 -20.6 30.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 72.14 110.933 -179.992 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -89.25 11.96 17.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 74.44 111.107 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.6 mmmt -136.94 9.34 3.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 54.43 110.928 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.538 HG23 ' O ' ' A' ' 6' ' ' PRO . 2.8 pp -117.51 -18.64 6.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 53.45 111.158 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.538 HG23 ' O ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -61.92 -16.15 15.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.149 -0.478 . . . . 72.33 111.104 179.82 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.243 -0.435 . . . . 72.21 111.094 179.813 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.878 0.371 . . . . 74.21 110.874 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.23 -15.92 50.12 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.201 -0.454 . . . . 74.43 110.941 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.38 -6.63 22.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 74.2 110.926 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.413 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 15.9 mt -103.16 -21.81 13.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 62.44 110.909 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.471 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -73.05 -60.97 1.64 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.64 0.733 . . . . 75.33 111.199 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.559 ' HA ' HD11 ' A' ' 10' ' ' ILE . 53.8 Cg_endo -69.81 -17.08 37.57 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.692 2.261 . . . . 64.41 112.336 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.512 HD23 HD11 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -112.43 5.61 18.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 72.14 110.94 179.964 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -47.03 -55.13 8.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 74.44 111.113 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.96 31.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.24 -0.436 . . . . 54.43 110.879 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.559 HD11 ' HA ' ' A' ' 6' ' ' PRO . 0.6 OUTLIER -114.04 11.46 8.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.249 -0.432 . . . . 53.45 111.1 179.889 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.52 ' H ' HD13 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -133.95 4.8 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.474 . . . . 72.33 111.134 179.877 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.467 . . . . 72.21 111.117 179.79 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.444 ' CG ' HD21 ' A' ' 4' ' ' LEU . 8.5 mtt180 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.815 0.34 . . . . 74.21 110.891 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.8 mtt -80.3 -1.32 40.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.218 -0.446 . . . . 74.43 110.874 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 39.7 tp -105.2 -26.72 11.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 74.2 110.928 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.531 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 pp -90.33 -22.92 21.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 62.44 110.921 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.529 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.01 -58.02 8.5 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.589 0.709 . . . . 75.33 111.145 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.7 Cg_endo -69.77 -25.53 28.47 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.643 2.228 . . . . 64.41 112.363 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.5 ' HG ' HG22 ' A' ' 10' ' ' ILE . 0.8 OUTLIER -87.56 -21.23 25.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 72.14 110.947 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -52.81 -28.29 21.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 74.44 111.106 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.25 -31.82 8.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 54.43 110.888 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.5 HG22 ' HG ' ' A' ' 7' ' ' LEU . 2.9 tp -52.55 -26.42 9.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 53.45 111.177 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.6 pt -65.96 -34.08 67.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 72.33 111.104 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.227 -0.442 . . . . 72.21 111.07 179.838 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.133 0 CA-C-O 120.78 0.324 . . . . 74.21 110.925 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.7 ttp -64.8 -13.93 57.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 74.43 110.929 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 41.3 tp -100.6 -13.42 18.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 74.2 110.916 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.518 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.2 mm? -96.61 -25.09 15.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.152 -0.476 . . . . 62.44 110.873 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.492 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -66.99 -59.62 7.36 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 121.52 0.676 . . . . 75.33 111.178 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.5 Cg_endo -69.79 -22.53 31.79 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.72 2.28 . . . . 64.41 112.327 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.635 ' O ' HG23 ' A' ' 11' ' ' ILE . 0.7 OUTLIER -90.62 -17.04 27.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 72.14 110.923 179.986 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.518 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -59.49 -19.95 51.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 74.44 111.057 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.3 mptt -119.77 -27.1 5.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.248 -0.433 . . . . 54.43 110.856 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.7 tp -54.45 -27.23 17.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.281 -0.418 . . . . 53.45 111.119 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.635 HG23 ' O ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -62.64 -16.13 16.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 72.33 111.142 179.829 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.167 -0.47 . . . . 72.21 111.161 179.791 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.492 ' HG3' HD22 ' A' ' 4' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.775 0.322 . . . . 74.21 110.872 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -11.04 60.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 74.43 110.867 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.48 -14.7 16.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 74.2 111.006 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.515 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 0.1 OUTLIER -96.43 -26.03 15.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 62.44 110.902 179.832 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.525 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -66.93 -57.79 10.71 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.572 0.701 . . . . 75.33 111.179 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.79 -24.37 29.6 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.719 2.28 . . . . 64.41 112.341 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.6 ' O ' HG23 ' A' ' 11' ' ' ILE . 3.8 tt -89.14 -17.96 28.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.21 -0.45 . . . . 72.14 110.89 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.515 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -59.61 -20.28 54.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 74.44 111.069 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -119.23 -26.69 5.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 54.43 110.948 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.4 HG22 ' HG ' ' A' ' 7' ' ' LEU . 2.7 tp -54.73 -26.14 16.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 53.45 111.105 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.6 HG23 ' O ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -63.78 -14.49 15.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 72.33 111.11 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 72.21 111.074 179.843 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.445 ' HG2' HD21 ' A' ' 4' ' ' LEU . 6.3 mtm180 . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 120.776 0.322 . . . . 74.21 110.877 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.26 -1.35 40.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.473 . . . . 74.43 110.96 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.14 -26.67 11.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 74.2 110.96 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 pp -90.3 -22.9 21.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 62.44 110.94 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.526 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.02 -58.0 8.5 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.655 0.74 . . . . 75.33 111.146 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.74 -25.53 28.58 Favored 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.742 2.295 . . . . 64.41 112.353 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.5 tt -86.45 -19.09 30.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.231 -0.44 . . . . 72.14 110.947 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.521 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -62.56 -16.75 57.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.461 . . . . 74.44 111.066 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.4 pttt -114.37 -24.39 8.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.211 -0.45 . . . . 54.43 110.891 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.5 tp -58.37 -21.54 18.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.243 -0.435 . . . . 53.45 111.111 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -103.14 4.74 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.466 . . . . 72.33 111.12 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 72.21 111.087 179.86 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.775 0.321 . . . . 74.21 110.921 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.8 ttm -72.96 -8.33 55.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 74.43 110.882 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.74 -19.42 14.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 74.2 110.933 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.529 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 13.4 mt -94.77 -23.13 17.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.247 -0.433 . . . . 62.44 110.917 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.522 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.51 -57.88 7.89 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 121.599 0.714 . . . . 75.33 111.184 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.522 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.4 Cg_endo -69.85 -25.84 27.77 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.7 2.267 . . . . 64.41 112.307 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.2 tp -88.85 -18.48 27.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 72.14 110.946 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -51.32 -30.56 18.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.18 -0.464 . . . . 74.44 111.133 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -62.88 1.5 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 54.43 110.918 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.51 -26.14 9.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.269 -0.423 . . . . 53.45 111.12 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.43 HG22 ' O ' ' A' ' 8' ' ' ALA . 2.7 tp -52.53 -26.25 9.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 72.33 111.101 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 72.21 111.156 179.746 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.815 0.341 . . . . 74.21 110.868 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -64.14 -14.79 57.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 74.43 110.879 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 mt -101.57 -9.72 20.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.194 -0.457 . . . . 74.2 110.923 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 21.6 mt -99.63 -25.43 14.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.175 -0.466 . . . . 62.44 110.917 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.505 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -68.33 -59.5 5.99 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.573 0.702 . . . . 75.33 111.162 179.96 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.505 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.7 -20.47 35.07 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.746 2.297 . . . . 64.41 112.356 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 28.1 tp -87.11 -21.06 26.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.223 -0.444 . . . . 72.14 110.977 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -90.88 43.75 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 74.44 111.089 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -168.62 -42.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 54.43 110.855 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.7 tp -55.01 -27.13 18.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.269 -0.423 . . . . 53.45 111.153 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.434 HD13 ' N ' ' A' ' 11' ' ' ILE . 0.2 OUTLIER -64.97 -15.42 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 72.33 111.046 179.878 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 72.21 111.076 179.882 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.7 ttt180 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.762 0.315 . . . . 74.21 110.876 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -72.6 -8.63 56.23 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.231 -0.44 . . . . 74.43 110.859 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 11.4 mt -102.75 -19.53 14.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.235 -0.439 . . . . 74.2 110.939 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -93.37 -24.27 18.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.197 -0.456 . . . . 62.44 110.902 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.531 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -67.83 -57.87 9.02 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.582 0.706 . . . . 75.33 111.116 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.73 -23.96 30.33 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.705 2.27 . . . . 64.41 112.368 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.63 ' HG ' HD13 ' A' ' 11' ' ' ILE . 1.0 OUTLIER -84.45 -24.55 29.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.454 . . . . 72.14 110.909 179.944 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.91 -18.31 60.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 74.44 111.117 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -92.6 -2.11 56.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 54.43 110.924 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.443 ' C ' HD12 ' A' ' 10' ' ' ILE . 2.9 pp -128.0 -1.38 3.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 53.45 111.208 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.63 HD13 ' HG ' ' A' ' 7' ' ' LEU . 1.2 tp -79.78 -26.55 12.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.12 -0.491 . . . . 72.33 111.068 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 72.21 111.149 179.821 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.408 ' CG ' HD21 ' A' ' 4' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.75 0.31 . . . . 74.21 110.813 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -81.11 -0.7 41.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 74.43 110.83 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.5 mt -105.56 -26.88 11.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.445 . . . . 74.2 110.921 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.531 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 pp -90.61 -22.74 21.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 62.44 110.969 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.531 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.31 -58.0 8.04 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.58 0.705 . . . . 75.33 111.1 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.4 Cg_endo -69.74 -25.54 28.57 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.762 2.308 . . . . 64.41 112.347 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.67 -21.68 25.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 72.14 110.985 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -51.41 -30.54 19.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 74.44 111.092 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -76.23 -59.78 2.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 54.43 111.0 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.53 -26.16 9.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 53.45 111.196 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.403 HG22 ' O ' ' A' ' 8' ' ' ALA . 2.7 tp -52.5 -26.19 9.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 72.33 111.169 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.154 -0.476 . . . . 72.21 111.091 179.794 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.739 0.305 . . . . 74.21 110.858 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.2 ttm -66.88 -13.42 61.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.453 . . . . 74.43 110.869 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.41 -9.2 20.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.294 -0.412 . . . . 74.2 110.841 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -103.86 -23.57 13.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.212 -0.449 . . . . 62.44 110.942 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.538 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -69.16 -57.57 7.24 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.594 0.711 . . . . 75.33 111.123 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.81 -24.64 29.22 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.703 2.269 . . . . 64.41 112.282 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.841 HD13 HD11 ' A' ' 10' ' ' ILE . 3.7 mm? -82.05 -29.41 31.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.249 -0.432 . . . . 72.14 110.959 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.13 58.73 1.61 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 74.44 111.115 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -178.7 -49.31 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.248 -0.433 . . . . 54.43 110.915 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.841 HD11 HD13 ' A' ' 7' ' ' LEU . 2.4 pt -64.43 -13.5 14.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 53.45 111.155 179.875 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.412 HG23 ' O ' ' A' ' 7' ' ' LEU . 2.0 pt -58.33 -19.27 13.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 72.33 111.152 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.449 . . . . 72.21 111.129 179.793 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.782 0.325 . . . . 74.21 110.9 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 33.1 ttm -70.03 -10.74 59.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 74.43 110.846 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 48.9 mt -102.65 -15.49 16.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 74.2 110.914 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.89 -26.51 16.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.175 -0.466 . . . . 62.44 110.955 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.525 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -66.8 -57.66 11.23 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.548 0.69 . . . . 75.33 111.121 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.79 -22.95 31.24 Favored 'Trans proline' 0 N--CA 1.464 -0.232 0 C-N-CA 122.691 2.261 . . . . 64.41 112.386 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.6 tt -85.78 -21.55 28.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 72.14 110.915 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -83.52 3.98 29.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.233 -0.439 . . . . 74.44 111.088 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.56 -37.7 5.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 54.43 110.889 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.3 pt -67.65 -28.41 41.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 53.45 111.118 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.7 pt -87.47 43.14 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.208 -0.451 . . . . 72.33 111.134 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 72.21 111.064 179.828 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.592 ' HG2' HD11 ' A' ' 4' ' ' LEU . 2.5 mtt180 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.872 0.368 . . . . 74.21 110.887 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.5 ptt? -85.73 -1.39 57.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.445 . . . . 74.43 110.884 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 84.6 mt -106.46 -20.29 13.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.243 -0.435 . . . . 74.2 110.888 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.592 HD11 ' HG2' ' A' ' 1' ' ' ARG . 3.5 pp -99.89 -21.04 15.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.235 -0.438 . . . . 62.44 110.943 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.541 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -70.05 -57.2 6.41 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.553 0.692 . . . . 75.33 111.155 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.72 -26.79 27.41 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.681 2.254 . . . . 64.41 112.354 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.733 ' O ' HG23 ' A' ' 11' ' ' ILE . 3.9 mm? -80.68 -24.05 39.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 72.14 110.961 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -81.52 0.18 39.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.45 . . . . 74.44 111.052 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.22 2.08 13.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.291 -0.413 . . . . 54.43 110.907 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.465 ' C ' HD12 ' A' ' 10' ' ' ILE . 2.9 pp -121.43 -10.62 9.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 53.45 111.174 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.733 HG23 ' O ' ' A' ' 7' ' ' LEU . 2.7 pp -63.04 -15.65 16.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.142 -0.481 . . . . 72.33 111.159 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.693 ' N ' HD12 ' A' ' 11' ' ' ILE . . . . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 72.21 111.088 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.615 ' HG2' HD22 ' A' ' 4' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.792 0.33 . . . . 74.21 110.855 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.2 mtt -60.78 -18.09 53.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 74.43 110.938 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.483 ' O ' HD23 ' A' ' 7' ' ' LEU . 6.4 mt -101.43 -0.73 34.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 74.2 110.856 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.615 HD22 ' HG2' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -109.93 -25.92 10.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.242 -0.436 . . . . 62.44 110.879 179.969 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.494 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -68.61 -59.58 5.59 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 121.592 0.711 . . . . 75.33 111.175 179.92 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.74 -21.68 33.24 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.722 2.281 . . . . 64.41 112.366 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.483 HD23 ' O ' ' A' ' 3' ' ' LEU . 4.5 mm? -86.62 -21.58 26.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 72.14 110.896 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.99 58.02 1.44 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 74.44 111.094 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -166.15 -48.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 54.43 110.869 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -88.89 -1.4 8.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 53.45 111.107 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.545 ' C ' HD12 ' A' ' 11' ' ' ILE . 2.8 pp -91.39 14.35 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 72.33 111.141 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 72.21 111.087 179.861 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.094 0 CA-C-O 120.812 0.339 . . . . 74.21 110.841 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 mtm -67.83 -12.73 61.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.167 -0.47 . . . . 74.43 110.86 179.955 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.478 ' O ' HD13 ' A' ' 7' ' ' LEU . 7.2 mt -104.13 -6.69 20.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.28 -0.418 . . . . 74.2 110.901 -179.975 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.426 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 13.2 mt -108.17 -20.51 13.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 62.44 110.922 179.881 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.524 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -73.16 -58.33 2.52 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.544 0.688 . . . . 75.33 111.184 179.91 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.69 ' HG2' HD12 ' A' ' 7' ' ' LEU . 54.3 Cg_endo -69.73 -23.71 30.63 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.711 2.274 . . . . 64.41 112.387 179.873 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.69 HD12 ' HG2' ' A' ' 6' ' ' PRO . 3.8 mp -107.16 6.63 28.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.915 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.507 ' HB1' ' HD3' ' A' ' 9' ' ' LYS . . . -46.67 -53.24 12.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.471 . . . . 74.44 111.137 179.79 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.507 ' HD3' ' HB1' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -179.46 36.23 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.465 . . . . 54.43 110.917 179.997 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.483 HD11 ' HA ' ' A' ' 6' ' ' PRO . 0.5 OUTLIER -125.16 18.95 4.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 53.45 111.122 179.851 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.507 ' H ' HD13 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -135.53 6.19 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.19 -0.459 . . . . 72.33 111.134 179.851 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.493 . . . . 72.21 111.16 179.796 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.825 0.345 . . . . 74.21 110.934 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 27.7 mtm -64.16 -15.68 60.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 74.43 110.873 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.432 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -102.07 -4.96 25.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.231 -0.44 . . . . 74.2 110.916 -179.977 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.513 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 mm? -108.22 -23.56 11.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 62.44 110.82 179.962 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.53 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -69.69 -57.93 6.15 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.672 0.749 . . . . 75.33 111.146 179.988 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.1 Cg_endo -69.73 -25.41 28.78 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.65 2.234 . . . . 64.41 112.379 179.913 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.432 HD23 ' O ' ' A' ' 3' ' ' LEU . 4.5 mm? -85.6 -21.73 28.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 72.14 110.881 -179.982 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.513 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -62.14 -20.72 64.39 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.169 -0.468 . . . . 74.44 111.08 179.825 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.0 -29.26 11.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 54.43 110.906 179.976 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.22 -26.98 9.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.221 -0.445 . . . . 53.45 111.146 179.816 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.6 pt -67.02 -35.71 75.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 72.33 111.141 179.901 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 72.21 111.101 179.812 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.469 ' HA ' HD21 ' A' ' 4' ' ' LEU . 10.7 ttt180 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.789 0.328 . . . . 74.21 110.869 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -84.17 4.64 29.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 74.43 110.931 179.968 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.77 -5.94 13.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.48 . . . . 74.2 110.933 -179.971 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.549 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.57 -23.94 10.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 62.44 110.951 179.897 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.496 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -68.34 -59.5 5.98 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.547 0.689 . . . . 75.33 111.174 179.896 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.2 Cg_endo -69.78 -25.91 28.02 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.695 2.263 . . . . 64.41 112.387 179.902 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.49 ' HG ' HG22 ' A' ' 10' ' ' ILE . 2.1 tt -87.13 -19.33 28.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 72.14 110.973 179.902 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.549 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -52.43 -28.4 19.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 74.44 111.118 179.742 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -106.6 -32.25 8.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 54.43 110.908 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.49 HG22 ' HG ' ' A' ' 7' ' ' LEU . 3.0 tp -52.06 -26.47 8.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 53.45 111.208 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.7 pt -65.37 -36.03 76.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.114 -0.494 . . . . 72.33 111.189 179.781 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.189 -0.46 . . . . 72.21 111.078 179.808 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.771 0.319 . . . . 74.21 110.862 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.4 ttm -77.37 -4.38 44.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.449 . . . . 74.43 110.853 179.946 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.804 HD12 HD13 ' A' ' 7' ' ' LEU . 41.5 tp -107.69 -11.72 15.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.439 . . . . 74.2 110.957 179.945 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.459 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.0 mm? -106.86 -20.14 13.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.204 -0.453 . . . . 62.44 110.899 179.905 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.538 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -73.17 -57.92 2.67 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.596 0.713 . . . . 75.33 111.14 179.943 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.688 ' HG2' HD12 ' A' ' 7' ' ' LEU . 53.8 Cg_endo -69.84 -23.88 29.95 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.634 2.222 . . . . 64.41 112.34 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.804 HD13 HD12 ' A' ' 3' ' ' LEU . 5.3 mp -106.51 5.87 29.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.454 . . . . 72.14 110.951 179.913 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.459 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -47.73 -51.92 20.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 74.44 111.053 179.804 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.632 ' H ' HD13 ' A' ' 10' ' ' ILE . 0.0 OUTLIER 179.7 33.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 54.43 110.869 179.993 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.632 HD13 ' H ' ' A' ' 9' ' ' LYS . 0.1 OUTLIER -128.45 27.73 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 53.45 111.159 179.859 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.711 HD12 ' HA ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -114.79 13.7 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.486 . . . . 72.33 111.135 179.899 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.134 -0.485 . . . . 72.21 111.017 179.829 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.778 0.323 . . . . 74.21 110.831 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -59.76 -18.45 43.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.153 -0.476 . . . . 74.43 110.897 179.932 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.9 mt -102.24 0.92 35.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 74.2 110.913 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.415 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 mm? -112.25 -22.16 11.07 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.231 -0.44 . . . . 62.44 110.889 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.48 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -73.5 -60.86 1.55 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.575 0.702 . . . . 75.33 111.155 179.884 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.5 Cg_endo -69.72 -18.39 37.23 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.687 2.258 . . . . 64.41 112.375 179.905 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.451 HD23 HG21 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -112.57 7.98 19.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.267 -0.424 . . . . 72.14 110.962 179.911 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -47.1 -67.03 0.32 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 74.44 111.032 179.805 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.0 35.74 0.21 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.263 -0.426 . . . . 54.43 110.878 179.956 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.477 HD11 ' HA ' ' A' ' 6' ' ' PRO . 0.5 OUTLIER -122.62 2.83 5.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 53.45 111.153 179.82 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.451 HG21 HD23 ' A' ' 7' ' ' LEU . 1.5 pt -66.09 -36.5 77.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 72.33 111.121 179.849 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 72.21 111.081 179.867 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.656 ' HG2' HD11 ' A' ' 4' ' ' LEU . 3.5 mtm180 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.788 0.328 . . . . 74.21 110.869 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.86 -2.23 57.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 74.43 110.875 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.493 ' O ' HD22 ' A' ' 7' ' ' LEU . 19.0 mt -105.59 -19.46 13.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.254 -0.43 . . . . 74.2 110.94 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.656 HD11 ' HG2' ' A' ' 1' ' ' ARG . 3.4 pp -101.56 -20.48 15.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.204 -0.453 . . . . 62.44 110.904 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.539 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -69.91 -57.2 6.6 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.595 0.712 . . . . 75.33 111.142 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.539 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.75 -28.32 25.43 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.642 2.228 . . . . 64.41 112.353 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.493 HD22 ' O ' ' A' ' 3' ' ' LEU . 9.9 mp -83.73 -23.85 31.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.246 -0.434 . . . . 72.14 110.934 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.528 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -51.89 -29.79 21.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 74.44 111.028 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -63.35 1.41 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 54.43 110.833 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.0 tp -51.34 -27.76 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 53.45 111.132 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.451 HG22 ' O ' ' A' ' 8' ' ' ALA . 2.5 tp -55.2 -26.68 18.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.212 -0.449 . . . . 72.33 111.108 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -129.31 -0.85 5.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.21 111.079 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -90.08 4.47 50.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.265 -0.425 . . . . 61.44 110.825 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.467 ' C ' HD12 ' A' ' 14' ' ' ILE . 2.9 pp -121.57 -10.25 9.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.235 -0.439 . . . . 73.32 111.145 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -94.9 -20.68 19.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 73.4 110.948 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.31 -33.51 12.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.07 -0.514 . . . . 75.33 110.903 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.44 HD12 ' N ' ' A' ' 18' ' ' ALA . 2.5 pp -79.71 -32.51 14.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.165 -0.47 . . . . 74.43 111.106 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.44 ' N ' HD12 ' A' ' 17' ' ' ILE . . . -105.08 -22.9 13.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 62.43 111.124 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 C-N-CA 120.67 -0.776 . . . . 54.33 112.512 -179.957 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.774 0.321 . . . . 74.21 110.85 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -18.7 46.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.202 -0.454 . . . . 74.43 110.894 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.614 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -100.86 -0.26 37.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 74.2 110.869 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.557 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.2 mm? -111.78 -24.06 10.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.197 -0.456 . . . . 62.44 110.969 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.503 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -69.5 -59.69 4.61 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 121.568 0.699 . . . . 75.33 111.143 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.1 Cg_endo -69.76 -23.62 30.6 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.668 2.245 . . . . 64.41 112.334 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.614 HD13 ' O ' ' A' ' 3' ' ' LEU . 8.6 mp -89.51 -18.76 26.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.245 -0.434 . . . . 72.14 110.941 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.557 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -54.51 -26.01 29.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.161 -0.472 . . . . 74.44 111.058 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -74.06 -62.57 1.46 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 54.43 110.865 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.0 pt -61.66 -21.34 25.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.256 -0.429 . . . . 53.45 111.099 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.461 HG22 ' O ' ' A' ' 8' ' ' ALA . 2.6 tp -52.21 -26.51 8.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.18 -0.464 . . . . 72.33 111.108 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -119.85 -31.54 4.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 72.21 111.097 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -51.89 -40.98 61.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.248 -0.433 . . . . 61.44 110.832 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.5 pt -68.69 -36.33 73.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 73.32 111.097 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.43 -16.62 59.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 73.4 110.869 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -89.41 -37.39 14.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 75.33 110.928 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 25.6 pt -84.6 -31.77 7.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 74.43 111.114 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -98.64 -21.99 16.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 62.43 111.082 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 C-N-CA 120.724 -0.75 . . . . 54.33 112.471 -179.953 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.6 mtm-85 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.804 0.335 . . . . 74.21 110.866 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 22.4 mtt -64.26 -14.52 56.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 74.43 110.885 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt -101.23 -10.72 20.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 74.2 110.916 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.5 mt -98.79 -25.69 14.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.149 -0.478 . . . . 62.44 110.922 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.495 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -67.44 -59.61 6.87 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.538 0.685 . . . . 75.33 111.058 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.553 ' O ' HG23 ' A' ' 10' ' ' ILE . 53.8 Cg_endo -69.78 -21.19 33.75 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.611 2.207 . . . . 64.41 112.388 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.3 tt -87.53 -17.29 32.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 72.14 110.941 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -88.74 15.06 8.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 74.44 111.1 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -144.08 14.84 1.69 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.135 -0.484 . . . . 54.43 110.889 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.553 HG23 ' O ' ' A' ' 6' ' ' PRO . 2.9 pp -117.08 -23.57 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.271 -0.422 . . . . 53.45 111.197 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.531 ' N ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -65.86 -17.16 21.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 72.33 111.117 179.861 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -118.37 -22.83 7.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 72.21 111.135 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -79.88 -0.95 36.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.209 -0.45 . . . . 61.44 110.9 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.591 ' HA ' HG22 ' A' ' 17' ' ' ILE . 2.8 pp -106.59 -12.42 10.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 73.32 111.102 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.83 -9.78 57.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 73.4 110.911 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -113.21 -44.46 3.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.172 -0.467 . . . . 75.33 110.881 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.591 HG22 ' HA ' ' A' ' 14' ' ' ILE . 11.2 tp -69.08 -30.15 45.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 74.43 111.14 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -142.1 12.82 2.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.145 -0.479 . . . . 62.43 111.132 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 C-N-CA 120.727 -0.749 . . . . 54.33 112.543 -179.956 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.709 0.29 . . . . 74.21 110.828 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 mtt -59.91 -18.26 43.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 74.43 110.899 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.551 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -101.82 0.27 35.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 74.2 110.912 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 11.2 mt -112.11 -22.04 11.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.137 -0.483 . . . . 62.44 110.926 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.489 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -72.75 -60.49 1.94 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.62 0.724 . . . . 75.33 111.185 179.877 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.734 ' HG2' HD12 ' A' ' 7' ' ' LEU . 53.4 Cg_endo -69.83 -20.48 34.47 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.641 2.227 . . . . 64.41 112.296 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.734 HD12 ' HG2' ' A' ' 6' ' ' PRO . 4.1 mp -109.24 6.5 24.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 72.14 110.93 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -47.25 -52.4 16.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.446 . . . . 74.44 111.16 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.677 ' H ' HD13 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -179.89 36.79 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 54.43 110.944 179.957 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.677 HD13 ' H ' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -125.54 19.08 4.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 53.45 111.154 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.507 ' H ' HD13 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -135.86 6.29 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 72.33 111.131 179.835 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -178.67 32.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 72.21 111.098 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -122.26 -33.91 3.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 61.44 110.88 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.46 HD13 ' H ' ' A' ' 14' ' ' ILE . 0.1 OUTLIER -114.19 -20.39 6.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.251 -0.431 . . . . 73.32 111.104 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -89.5 -8.31 53.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.141 -0.482 . . . . 73.4 110.9 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -106.74 -41.09 5.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.142 -0.481 . . . . 75.33 110.873 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.2 tp -73.0 -30.92 33.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.169 -0.468 . . . . 74.43 111.11 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.67 -20.06 9.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.178 -0.465 . . . . 62.43 111.139 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 C-N-CA 120.768 -0.73 . . . . 54.33 112.481 -179.98 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.526 0.055 0 CA-C-O 120.728 0.299 . . . . 74.21 110.835 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.5 ttt -72.98 -8.27 54.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 74.43 110.916 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 30.6 tp -102.67 -19.86 14.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.227 -0.442 . . . . 74.2 110.858 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.528 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.2 mm? -93.79 -23.84 18.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 62.44 110.85 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.531 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -67.89 -57.93 8.83 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.63 0.729 . . . . 75.33 111.164 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.67 -25.49 28.97 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.722 2.281 . . . . 64.41 112.36 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.498 ' HG ' HG22 ' A' ' 10' ' ' ILE . 0.9 OUTLIER -88.17 -19.6 26.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 72.14 110.964 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.528 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -54.54 -26.43 31.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.466 . . . . 74.44 111.099 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -107.56 -30.23 8.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.435 . . . . 54.43 110.892 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.498 HG22 ' HG ' ' A' ' 7' ' ' LEU . 2.7 tp -54.93 -25.04 15.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 53.45 111.152 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.6 pt -64.97 -15.12 17.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.48 . . . . 72.33 111.071 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -119.41 -26.41 5.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 72.21 111.123 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 63.0 m170 -57.8 -23.92 54.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 61.44 110.91 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.506 ' HA ' HG22 ' A' ' 17' ' ' ILE . 2.9 pp -118.61 -12.82 10.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.192 -0.458 . . . . 73.32 111.049 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.6 ttt-85 -92.13 -17.45 24.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 73.4 110.839 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -104.74 -37.01 7.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.238 -0.437 . . . . 75.33 110.924 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.506 HG22 ' HA ' ' A' ' 14' ' ' ILE . 11.1 tp -70.46 -30.01 41.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.156 -0.475 . . . . 74.43 111.132 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -117.75 -16.35 10.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 62.43 111.077 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 C-N-CA 120.731 -0.747 . . . . 54.33 112.46 -179.962 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.769 0.318 . . . . 74.21 110.856 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -63.78 -15.86 59.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 74.43 110.903 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.559 ' O ' HD22 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -102.85 -4.29 25.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 74.2 110.907 -179.941 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 16.5 mt -106.6 -24.62 12.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 62.44 110.958 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.537 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -70.0 -57.79 5.9 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 121.548 0.69 . . . . 75.33 111.116 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.75 -19.9 35.57 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.717 2.278 . . . . 64.41 112.291 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.559 HD22 ' O ' ' A' ' 3' ' ' LEU . 11.0 mp -89.56 -19.95 24.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.258 -0.428 . . . . 72.14 110.933 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.64 16.55 11.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.449 . . . . 74.44 111.061 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.09 -32.35 3.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 54.43 110.945 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.9 pt -72.04 -35.15 52.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 53.45 111.135 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.7 pt -59.8 -19.19 16.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 72.33 111.158 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -117.36 -15.56 10.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.17 -0.468 . . . . 72.21 111.133 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -68.7 -24.55 64.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 61.44 110.78 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.508 ' HA ' HG22 ' A' ' 17' ' ' ILE . 2.9 pp -121.42 0.84 6.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.249 -0.432 . . . . 73.32 111.077 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -101.78 -19.79 15.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.184 -0.462 . . . . 73.4 110.798 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.6 -32.17 7.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 75.33 110.968 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.508 HG22 ' HA ' ' A' ' 14' ' ' ILE . 11.0 tp -72.18 -30.02 34.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.06 -0.518 . . . . 74.43 111.107 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -117.26 -18.46 9.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 62.43 111.132 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.281 0 C-N-CA 120.682 -0.771 . . . . 54.33 112.494 -179.987 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.2 mpp_? . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.868 0.366 . . . . 74.21 110.86 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.2 ptp -72.51 -8.64 56.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 74.43 110.917 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.9 -19.66 14.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.446 . . . . 74.2 110.94 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -92.62 -24.59 18.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 62.44 110.928 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.54 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -67.85 -57.79 9.13 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.535 0.683 . . . . 75.33 111.103 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.71 -23.44 31.03 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.669 2.246 . . . . 64.41 112.335 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.538 ' O ' HG23 ' A' ' 11' ' ' ILE . 0.7 OUTLIER -84.99 -20.6 30.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 72.14 110.933 -179.992 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -89.25 11.96 17.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 74.44 111.107 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.6 mmmt -136.94 9.34 3.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 54.43 110.928 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.538 HG23 ' O ' ' A' ' 6' ' ' PRO . 2.8 pp -117.51 -18.64 6.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 53.45 111.158 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.538 HG23 ' O ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -61.92 -16.15 15.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.149 -0.478 . . . . 72.33 111.104 179.82 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -124.43 -34.81 2.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.243 -0.435 . . . . 72.21 111.094 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.51 ' O ' HG23 ' A' ' 17' ' ' ILE . 84.5 t60 -50.35 -37.07 35.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 61.44 110.852 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.8 pt -67.01 -36.41 77.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 73.32 111.183 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.94 -19.16 48.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.475 . . . . 73.4 110.864 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -90.01 -33.4 16.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.202 -0.454 . . . . 75.33 110.881 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.51 HG23 ' O ' ' A' ' 13' ' ' HIS . 2.3 pp -86.25 -32.06 6.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 74.43 111.154 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -96.73 -23.31 16.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.464 . . . . 62.43 111.125 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.255 0 C-N-CA 120.668 -0.777 . . . . 54.33 112.474 179.972 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.878 0.371 . . . . 74.21 110.874 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.23 -15.92 50.12 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.201 -0.454 . . . . 74.43 110.941 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.38 -6.63 22.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 74.2 110.926 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.413 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 15.9 mt -103.16 -21.81 13.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 62.44 110.909 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.471 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -73.05 -60.97 1.64 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.64 0.733 . . . . 75.33 111.199 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.559 ' HA ' HD11 ' A' ' 10' ' ' ILE . 53.8 Cg_endo -69.81 -17.08 37.57 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.692 2.261 . . . . 64.41 112.336 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.512 HD23 HD11 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -112.43 5.61 18.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 72.14 110.94 179.964 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -47.03 -55.13 8.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 74.44 111.113 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.96 31.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.24 -0.436 . . . . 54.43 110.879 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.559 HD11 ' HA ' ' A' ' 6' ' ' PRO . 0.6 OUTLIER -114.04 11.46 8.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.249 -0.432 . . . . 53.45 111.1 179.889 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.52 ' H ' HD13 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -133.95 4.8 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.474 . . . . 72.33 111.134 179.877 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -153.63 19.07 0.54 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.467 . . . . 72.21 111.117 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 -123.76 -36.4 2.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 61.44 110.868 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.5 pt -68.32 -36.41 74.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 73.32 111.149 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.35 -16.5 59.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.186 -0.461 . . . . 73.4 110.84 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -90.43 -35.62 15.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 75.33 110.899 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 25.5 pt -85.73 -31.74 6.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.121 -0.49 . . . . 74.43 111.087 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -97.09 -22.08 16.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.246 -0.434 . . . . 62.43 111.089 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.231 0 C-N-CA 120.757 -0.735 . . . . 54.33 112.457 -179.98 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.444 ' CG ' HD21 ' A' ' 4' ' ' LEU . 8.5 mtt180 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.815 0.34 . . . . 74.21 110.891 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.8 mtt -80.3 -1.32 40.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.218 -0.446 . . . . 74.43 110.874 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 39.7 tp -105.2 -26.72 11.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 74.2 110.928 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.531 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 pp -90.33 -22.92 21.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 62.44 110.921 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.529 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.01 -58.02 8.5 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.589 0.709 . . . . 75.33 111.145 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.7 Cg_endo -69.77 -25.53 28.47 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.643 2.228 . . . . 64.41 112.363 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.5 ' HG ' HG22 ' A' ' 10' ' ' ILE . 0.8 OUTLIER -87.56 -21.23 25.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 72.14 110.947 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -52.81 -28.29 21.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 74.44 111.106 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.25 -31.82 8.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 54.43 110.888 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.5 HG22 ' HG ' ' A' ' 7' ' ' LEU . 2.9 tp -52.55 -26.42 9.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 53.45 111.177 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.6 pt -65.96 -34.08 67.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 72.33 111.104 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -97.78 -14.84 20.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.227 -0.442 . . . . 72.21 111.07 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.568 ' O ' HG23 ' A' ' 17' ' ' ILE . 12.9 t-80 -75.67 -43.0 49.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 61.44 110.866 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.5 pt -66.3 -36.56 77.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 73.32 111.147 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.3 ptt85 -80.14 -14.26 58.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 73.4 110.909 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -97.76 -26.53 14.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.136 -0.484 . . . . 75.33 110.895 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.568 HG23 ' O ' ' A' ' 13' ' ' HIS . 2.5 pp -90.27 -33.44 5.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.112 -0.494 . . . . 74.43 111.126 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.466 ' HB2' HD12 ' A' ' 17' ' ' ILE . . . -121.3 19.46 11.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 62.43 111.111 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.268 0 C-N-CA 120.68 -0.772 . . . . 54.33 112.477 -179.929 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.133 0 CA-C-O 120.78 0.324 . . . . 74.21 110.925 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.7 ttp -64.8 -13.93 57.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 74.43 110.929 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 41.3 tp -100.6 -13.42 18.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 74.2 110.916 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.518 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.2 mm? -96.61 -25.09 15.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.152 -0.476 . . . . 62.44 110.873 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.492 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -66.99 -59.62 7.36 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 121.52 0.676 . . . . 75.33 111.178 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.5 Cg_endo -69.79 -22.53 31.79 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.72 2.28 . . . . 64.41 112.327 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.635 ' O ' HG23 ' A' ' 11' ' ' ILE . 0.7 OUTLIER -90.62 -17.04 27.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 72.14 110.923 179.986 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.518 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -59.49 -19.95 51.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 74.44 111.057 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.3 mptt -119.77 -27.1 5.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.248 -0.433 . . . . 54.43 110.856 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.7 tp -54.45 -27.23 17.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.281 -0.418 . . . . 53.45 111.119 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.635 HG23 ' O ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -62.64 -16.13 16.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 72.33 111.142 179.829 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -124.31 -16.93 6.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.167 -0.47 . . . . 72.21 111.161 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -54.24 -37.53 64.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.2 -0.454 . . . . 61.44 110.883 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.42 HD13 ' H ' ' A' ' 14' ' ' ILE . 0.1 OUTLIER -116.22 4.45 7.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 73.32 111.166 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.2 ttp85 -108.38 -11.99 15.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.468 . . . . 73.4 110.918 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -113.09 -33.7 5.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.47 . . . . 75.33 110.915 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.3 tp -73.49 -31.39 32.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 74.43 111.06 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.7 -21.24 9.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.161 -0.472 . . . . 62.43 111.165 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.375 0 C-N-CA 120.743 -0.742 . . . . 54.33 112.554 -179.963 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.492 ' HG3' HD22 ' A' ' 4' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.775 0.322 . . . . 74.21 110.872 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -11.04 60.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 74.43 110.867 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.48 -14.7 16.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 74.2 111.006 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.515 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 0.1 OUTLIER -96.43 -26.03 15.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 62.44 110.902 179.832 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.525 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -66.93 -57.79 10.71 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.572 0.701 . . . . 75.33 111.179 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.79 -24.37 29.6 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.719 2.28 . . . . 64.41 112.341 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.6 ' O ' HG23 ' A' ' 11' ' ' ILE . 3.8 tt -89.14 -17.96 28.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.21 -0.45 . . . . 72.14 110.89 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.515 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -59.61 -20.28 54.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 74.44 111.069 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -119.23 -26.69 5.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 54.43 110.948 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.4 HG22 ' HG ' ' A' ' 7' ' ' LEU . 2.7 tp -54.73 -26.14 16.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 53.45 111.105 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.6 HG23 ' O ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -63.78 -14.49 15.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 72.33 111.11 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -120.94 -26.81 5.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 72.21 111.074 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 50.7 t-80 -57.08 -23.83 49.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 61.44 110.811 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.478 ' C ' HD12 ' A' ' 14' ' ' ILE . 2.9 pp -117.44 -18.57 6.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.434 . . . . 73.32 111.145 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.476 ' N ' HD12 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -92.14 -1.97 56.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.463 . . . . 73.4 110.856 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -111.97 -41.16 4.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.245 -0.434 . . . . 75.33 110.838 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.5 pp -75.09 -30.63 23.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 74.43 111.127 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.85 -22.45 8.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 62.43 111.043 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.741 -0.742 . . . . 54.33 112.536 -179.938 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.445 ' HG2' HD21 ' A' ' 4' ' ' LEU . 6.3 mtm180 . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 120.776 0.322 . . . . 74.21 110.877 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.26 -1.35 40.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.473 . . . . 74.43 110.96 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.14 -26.67 11.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 74.2 110.96 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 pp -90.3 -22.9 21.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 62.44 110.94 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.526 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.02 -58.0 8.5 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.655 0.74 . . . . 75.33 111.146 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.74 -25.53 28.58 Favored 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.742 2.295 . . . . 64.41 112.353 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.5 tt -86.45 -19.09 30.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.231 -0.44 . . . . 72.14 110.947 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.521 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -62.56 -16.75 57.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.461 . . . . 74.44 111.066 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.4 pttt -114.37 -24.39 8.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.211 -0.45 . . . . 54.43 110.891 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.5 tp -58.37 -21.54 18.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.243 -0.435 . . . . 53.45 111.111 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -103.14 4.74 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.466 . . . . 72.33 111.12 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -136.15 14.68 3.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 72.21 111.087 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -121.61 -34.25 3.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.243 -0.435 . . . . 61.44 110.841 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.48 ' C ' HD12 ' A' ' 14' ' ' ILE . 2.9 pp -118.25 -14.24 9.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.236 -0.438 . . . . 73.32 111.044 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.1 ttt-85 -95.65 -12.06 26.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 73.4 110.91 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -105.85 -37.02 6.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 75.33 110.851 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.3 tp -75.31 -30.87 23.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.135 -0.484 . . . . 74.43 111.114 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.66 -22.81 8.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.242 -0.435 . . . . 62.43 111.093 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 C-N-CA 120.726 -0.75 . . . . 54.33 112.432 -179.872 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.775 0.321 . . . . 74.21 110.921 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.8 ttm -72.96 -8.33 55.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 74.43 110.882 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.74 -19.42 14.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 74.2 110.933 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.529 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 13.4 mt -94.77 -23.13 17.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.247 -0.433 . . . . 62.44 110.917 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.522 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.51 -57.88 7.89 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 121.599 0.714 . . . . 75.33 111.184 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.522 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.4 Cg_endo -69.85 -25.84 27.77 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.7 2.267 . . . . 64.41 112.307 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.2 tp -88.85 -18.48 27.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 72.14 110.946 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -51.32 -30.56 18.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.18 -0.464 . . . . 74.44 111.133 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -62.88 1.5 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 54.43 110.918 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.51 -26.14 9.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.269 -0.423 . . . . 53.45 111.12 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.43 HG22 ' O ' ' A' ' 8' ' ' ALA . 2.7 tp -52.53 -26.25 9.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 72.33 111.101 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -115.65 -29.14 6.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 72.21 111.156 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -51.98 -35.94 48.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 61.44 110.86 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.488 ' HA ' HG22 ' A' ' 17' ' ' ILE . 1.5 pt -71.22 -35.23 57.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 73.32 111.131 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.5 mmt180 -77.54 -9.15 58.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.092 -0.504 . . . . 73.4 110.908 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -106.06 -40.83 5.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 75.33 110.938 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.488 HG22 ' HA ' ' A' ' 14' ' ' ILE . 11.0 tp -71.86 -29.87 35.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 74.43 111.133 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.98 -17.7 10.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 62.43 111.141 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 C-N-CA 120.76 -0.733 . . . . 54.33 112.487 -179.97 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.815 0.341 . . . . 74.21 110.868 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -64.14 -14.79 57.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 74.43 110.879 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 mt -101.57 -9.72 20.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.194 -0.457 . . . . 74.2 110.923 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 21.6 mt -99.63 -25.43 14.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.175 -0.466 . . . . 62.44 110.917 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.505 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -68.33 -59.5 5.99 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.573 0.702 . . . . 75.33 111.162 179.96 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.505 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.7 -20.47 35.07 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.746 2.297 . . . . 64.41 112.356 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 28.1 tp -87.11 -21.06 26.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.223 -0.444 . . . . 72.14 110.977 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -90.88 43.75 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 74.44 111.089 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -168.62 -42.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 54.43 110.855 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.7 tp -55.01 -27.13 18.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.269 -0.423 . . . . 53.45 111.153 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.434 HD13 ' N ' ' A' ' 11' ' ' ILE . 0.2 OUTLIER -64.97 -15.42 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 72.33 111.046 179.878 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -133.24 1.02 3.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 72.21 111.076 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.444 ' O ' HG22 ' A' ' 17' ' ' ILE . 1.6 t-80 -80.27 -31.07 38.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.44 . . . . 61.44 110.883 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.17 -18.83 17.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.242 -0.436 . . . . 73.32 111.14 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -95.41 -9.24 33.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 73.4 110.831 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -110.51 -32.93 6.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 75.33 110.838 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.444 HG22 ' O ' ' A' ' 13' ' ' HIS . 10.6 tp -79.55 -28.77 13.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 74.43 111.114 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.76 -25.56 7.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 62.43 111.161 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 C-N-CA 120.655 -0.783 . . . . 54.33 112.48 -179.993 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.7 ttt180 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.762 0.315 . . . . 74.21 110.876 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -72.6 -8.63 56.23 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.231 -0.44 . . . . 74.43 110.859 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 11.4 mt -102.75 -19.53 14.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.235 -0.439 . . . . 74.2 110.939 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -93.37 -24.27 18.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.197 -0.456 . . . . 62.44 110.902 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.531 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -67.83 -57.87 9.02 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.582 0.706 . . . . 75.33 111.116 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.73 -23.96 30.33 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.705 2.27 . . . . 64.41 112.368 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.63 ' HG ' HD13 ' A' ' 11' ' ' ILE . 1.0 OUTLIER -84.45 -24.55 29.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.454 . . . . 72.14 110.909 179.944 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.91 -18.31 60.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 74.44 111.117 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -92.6 -2.11 56.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 54.43 110.924 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.561 ' HA ' HD12 ' A' ' 14' ' ' ILE . 2.9 pp -128.0 -1.38 3.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 53.45 111.208 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.63 HD13 ' HG ' ' A' ' 7' ' ' LEU . 1.2 tp -79.78 -26.55 12.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.12 -0.491 . . . . 72.33 111.068 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -168.04 28.69 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 72.21 111.149 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -113.98 -9.64 12.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 61.44 110.847 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.561 HD12 ' HA ' ' A' ' 10' ' ' ILE . 0.0 OUTLIER -131.56 4.39 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.204 -0.453 . . . . 73.32 111.081 -179.971 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -106.37 -18.14 14.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.196 -0.456 . . . . 73.4 110.907 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -112.21 -29.13 7.68 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.235 -0.439 . . . . 75.33 110.844 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.5 HG22 ' HA ' ' A' ' 14' ' ' ILE . 10.8 tp -73.93 -29.77 26.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.129 -0.487 . . . . 74.43 111.151 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.97 -20.33 9.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 62.43 111.092 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 C-N-CA 120.733 -0.746 . . . . 54.33 112.461 -179.955 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.408 ' CG ' HD21 ' A' ' 4' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.75 0.31 . . . . 74.21 110.813 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -81.11 -0.7 41.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 74.43 110.83 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.5 mt -105.56 -26.88 11.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.445 . . . . 74.2 110.921 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.531 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 pp -90.61 -22.74 21.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 62.44 110.969 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.531 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.31 -58.0 8.04 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.58 0.705 . . . . 75.33 111.1 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.4 Cg_endo -69.74 -25.54 28.57 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.762 2.308 . . . . 64.41 112.347 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.67 -21.68 25.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 72.14 110.985 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -51.41 -30.54 19.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 74.44 111.092 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -76.23 -59.78 2.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 54.43 111.0 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.53 -26.16 9.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 53.45 111.196 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.403 HG22 ' O ' ' A' ' 8' ' ' ALA . 2.7 tp -52.5 -26.19 9.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 72.33 111.169 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -116.77 -27.38 6.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.154 -0.476 . . . . 72.21 111.091 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -54.03 -37.83 64.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 61.44 110.847 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.554 ' HA ' HG22 ' A' ' 17' ' ' ILE . 1.6 pt -72.63 -34.84 48.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.447 . . . . 73.32 111.186 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -76.56 -17.6 59.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.098 -0.501 . . . . 73.4 110.865 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -98.48 -37.24 9.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 75.33 110.911 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.554 HG22 ' HA ' ' A' ' 14' ' ' ILE . 10.9 tp -74.72 -29.61 23.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.146 -0.479 . . . . 74.43 111.148 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -109.47 -14.06 14.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.149 -0.478 . . . . 62.43 111.117 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 C-N-CA 120.766 -0.73 . . . . 54.33 112.467 -179.94 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.739 0.305 . . . . 74.21 110.858 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.2 ttm -66.88 -13.42 61.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.453 . . . . 74.43 110.869 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.41 -9.2 20.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.294 -0.412 . . . . 74.2 110.841 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -103.86 -23.57 13.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.212 -0.449 . . . . 62.44 110.942 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.538 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -69.16 -57.57 7.24 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.594 0.711 . . . . 75.33 111.123 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.81 -24.64 29.22 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.703 2.269 . . . . 64.41 112.282 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.841 HD13 HD11 ' A' ' 10' ' ' ILE . 3.7 mm? -82.05 -29.41 31.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.249 -0.432 . . . . 72.14 110.959 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.13 58.73 1.61 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 74.44 111.115 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -178.7 -49.31 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.248 -0.433 . . . . 54.43 110.915 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.841 HD11 HD13 ' A' ' 7' ' ' LEU . 2.4 pt -64.43 -13.5 14.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 53.45 111.155 179.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.412 HG23 ' O ' ' A' ' 7' ' ' LEU . 2.0 pt -58.33 -19.27 13.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 72.33 111.152 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -150.15 -37.49 0.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.449 . . . . 72.21 111.129 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 56.1 t-80 -48.23 -36.93 14.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.239 -0.437 . . . . 61.44 110.858 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.482 ' C ' HD12 ' A' ' 14' ' ' ILE . 2.9 pp -116.94 -4.09 10.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 73.32 111.15 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.47 -7.3 26.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 73.4 110.895 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.85 -42.11 3.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 75.33 110.865 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 35.0 pt -69.43 -29.99 43.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.2 -0.455 . . . . 74.43 111.118 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -145.43 15.01 1.45 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.459 . . . . 62.43 111.116 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 C-N-CA 120.757 -0.735 . . . . 54.33 112.502 -179.989 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.782 0.325 . . . . 74.21 110.9 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 33.1 ttm -70.03 -10.74 59.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 74.43 110.846 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 48.9 mt -102.65 -15.49 16.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 74.2 110.914 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.89 -26.51 16.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.175 -0.466 . . . . 62.44 110.955 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.525 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -66.8 -57.66 11.23 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.548 0.69 . . . . 75.33 111.121 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.79 -22.95 31.24 Favored 'Trans proline' 0 N--CA 1.464 -0.232 0 C-N-CA 122.691 2.261 . . . . 64.41 112.386 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.6 tt -85.78 -21.55 28.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 72.14 110.915 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -83.52 3.98 29.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.233 -0.439 . . . . 74.44 111.088 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.56 -37.7 5.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 54.43 110.889 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.3 pt -67.65 -28.41 41.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 53.45 111.118 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.7 pt -87.47 43.14 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.208 -0.451 . . . . 72.33 111.134 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 179.61 -33.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 72.21 111.064 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.01 -11.62 60.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.259 -0.428 . . . . 61.44 110.837 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.516 ' C ' HD12 ' A' ' 14' ' ' ILE . 2.8 pp -108.05 -14.64 9.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 73.32 111.106 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.431 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.5 ppt_? -94.98 2.06 55.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.455 . . . . 73.4 110.828 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -120.91 -39.94 2.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 75.33 110.869 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.2 tp -71.93 -31.09 39.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 74.43 111.144 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -152.45 19.85 0.63 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.195 -0.457 . . . . 62.43 111.171 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.784 -0.722 . . . . 54.33 112.485 179.99 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.592 ' HG2' HD11 ' A' ' 4' ' ' LEU . 2.5 mtt180 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.872 0.368 . . . . 74.21 110.887 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.5 ptt? -85.73 -1.39 57.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.445 . . . . 74.43 110.884 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 84.6 mt -106.46 -20.29 13.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.243 -0.435 . . . . 74.2 110.888 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.592 HD11 ' HG2' ' A' ' 1' ' ' ARG . 3.5 pp -99.89 -21.04 15.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.235 -0.438 . . . . 62.44 110.943 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.541 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -70.05 -57.2 6.41 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.553 0.692 . . . . 75.33 111.155 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.72 -26.79 27.41 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.681 2.254 . . . . 64.41 112.354 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.733 ' O ' HG23 ' A' ' 11' ' ' ILE . 3.9 mm? -80.68 -24.05 39.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 72.14 110.961 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -81.52 0.18 39.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.45 . . . . 74.44 111.052 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.22 2.08 13.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.291 -0.413 . . . . 54.43 110.907 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.465 ' C ' HD12 ' A' ' 10' ' ' ILE . 2.9 pp -121.43 -10.62 9.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 53.45 111.174 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.733 HG23 ' O ' ' A' ' 7' ' ' LEU . 2.7 pp -63.04 -15.65 16.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.142 -0.481 . . . . 72.33 111.159 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.693 ' N ' HD12 ' A' ' 11' ' ' ILE . . . -137.27 -41.89 0.57 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 72.21 111.088 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -60.04 -43.17 95.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 61.44 110.89 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.5 tp -68.66 -26.34 32.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 73.32 111.15 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -87.21 -10.65 52.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 73.4 110.872 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -104.16 -38.6 6.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.195 -0.457 . . . . 75.33 110.891 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 10.8 tp -76.45 -29.33 18.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 74.43 111.128 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.07 -21.4 10.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 62.43 111.1 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 C-N-CA 120.755 -0.736 . . . . 54.33 112.462 -179.983 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.615 ' HG2' HD22 ' A' ' 4' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.792 0.33 . . . . 74.21 110.855 . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.2 mtt -60.78 -18.09 53.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 74.43 110.938 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.483 ' O ' HD23 ' A' ' 7' ' ' LEU . 6.4 mt -101.43 -0.73 34.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 74.2 110.856 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.615 HD22 ' HG2' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -109.93 -25.92 10.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.242 -0.436 . . . . 62.44 110.879 179.969 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.494 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -68.61 -59.58 5.59 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 121.592 0.711 . . . . 75.33 111.175 179.92 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.74 -21.68 33.24 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.722 2.281 . . . . 64.41 112.366 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.483 HD23 ' O ' ' A' ' 3' ' ' LEU . 4.5 mm? -86.62 -21.58 26.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 72.14 110.896 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.99 58.02 1.44 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 74.44 111.094 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -166.15 -48.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 54.43 110.869 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -88.89 -1.4 8.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 53.45 111.107 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.545 ' C ' HD12 ' A' ' 11' ' ' ILE . 2.8 pp -91.39 14.35 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 72.33 111.141 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -154.05 -45.74 0.09 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 72.21 111.087 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 45.6 t60 -58.31 -36.21 73.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.219 -0.446 . . . . 61.44 110.917 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.5 tp -69.27 -26.19 31.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.446 . . . . 73.32 111.126 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -87.17 -10.49 52.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.466 . . . . 73.4 110.813 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.6 -39.02 6.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 75.33 110.903 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 10.9 tp -75.55 -29.48 20.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 74.43 111.082 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.5 -20.92 10.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 62.43 111.05 179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 C-N-CA 120.745 -0.741 . . . . 54.33 112.432 -179.877 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.094 0 CA-C-O 120.812 0.339 . . . . 74.21 110.841 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 mtm -67.83 -12.73 61.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.167 -0.47 . . . . 74.43 110.86 179.955 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.478 ' O ' HD13 ' A' ' 7' ' ' LEU . 7.2 mt -104.13 -6.69 20.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.28 -0.418 . . . . 74.2 110.901 -179.975 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.426 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 13.2 mt -108.17 -20.51 13.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 62.44 110.922 179.881 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.524 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -73.16 -58.33 2.52 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.544 0.688 . . . . 75.33 111.184 179.91 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.69 ' HG2' HD12 ' A' ' 7' ' ' LEU . 54.3 Cg_endo -69.73 -23.71 30.63 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.711 2.274 . . . . 64.41 112.387 179.873 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.69 HD12 ' HG2' ' A' ' 6' ' ' PRO . 3.8 mp -107.16 6.63 28.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.915 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.507 ' HB1' ' HD3' ' A' ' 9' ' ' LYS . . . -46.67 -53.24 12.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.471 . . . . 74.44 111.137 179.79 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.507 ' HD3' ' HB1' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -179.46 36.23 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.465 . . . . 54.43 110.917 179.997 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.483 HD11 ' HA ' ' A' ' 6' ' ' PRO . 0.5 OUTLIER -125.16 18.95 4.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 53.45 111.122 179.851 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.507 ' H ' HD13 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -135.53 6.19 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.19 -0.459 . . . . 72.33 111.134 179.851 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -178.49 32.06 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.493 . . . . 72.21 111.16 179.796 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -122.73 -32.37 3.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.467 . . . . 61.44 110.856 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.527 ' HA ' HG22 ' A' ' 17' ' ' ILE . 2.9 pp -118.72 -12.54 10.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 73.32 111.152 -179.99 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.53 -18.99 21.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.487 . . . . 73.4 110.822 -179.975 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -103.5 -34.48 8.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.26 -0.427 . . . . 75.33 110.862 -179.964 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.527 HG22 ' HA ' ' A' ' 14' ' ' ILE . 10.9 tp -73.2 -29.78 29.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.455 . . . . 74.43 111.141 179.977 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.74 -18.9 10.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 62.43 111.077 179.807 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 C-N-CA 120.747 -0.74 . . . . 54.33 112.461 -179.911 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.825 0.345 . . . . 74.21 110.934 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 27.7 mtm -64.16 -15.68 60.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 74.43 110.873 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.432 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -102.07 -4.96 25.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.231 -0.44 . . . . 74.2 110.916 -179.977 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.513 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 mm? -108.22 -23.56 11.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 62.44 110.82 179.962 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.53 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -69.69 -57.93 6.15 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.672 0.749 . . . . 75.33 111.146 179.988 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.1 Cg_endo -69.73 -25.41 28.78 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.65 2.234 . . . . 64.41 112.379 179.913 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.432 HD23 ' O ' ' A' ' 3' ' ' LEU . 4.5 mm? -85.6 -21.73 28.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 72.14 110.881 -179.982 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.513 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -62.14 -20.72 64.39 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.169 -0.468 . . . . 74.44 111.08 179.825 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.0 -29.26 11.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 54.43 110.906 179.976 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.22 -26.98 9.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.221 -0.445 . . . . 53.45 111.146 179.816 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.6 pt -67.02 -35.71 75.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 72.33 111.141 179.901 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.42 -46.09 20.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 72.21 111.101 179.812 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -55.78 -43.23 76.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 61.44 110.886 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.596 HD12 HD11 ' A' ' 17' ' ' ILE . 2.2 tp -57.79 -26.87 29.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 73.32 111.099 179.994 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -89.61 -10.12 47.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.447 . . . . 73.4 110.922 179.878 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -100.72 -30.32 11.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 75.33 110.861 -179.883 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.596 HD11 HD12 ' A' ' 14' ' ' ILE . 24.3 pt -89.29 -31.77 5.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.169 -0.469 . . . . 74.43 111.158 179.955 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.75 -21.95 19.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 62.43 111.116 179.798 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.293 0 C-N-CA 120.699 -0.763 . . . . 54.33 112.481 -179.928 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.469 ' HA ' HD21 ' A' ' 4' ' ' LEU . 10.7 ttt180 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.789 0.328 . . . . 74.21 110.869 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -84.17 4.64 29.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 74.43 110.931 179.968 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.77 -5.94 13.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.48 . . . . 74.2 110.933 -179.971 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.549 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.57 -23.94 10.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 62.44 110.951 179.897 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.496 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -68.34 -59.5 5.98 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.547 0.689 . . . . 75.33 111.174 179.896 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.2 Cg_endo -69.78 -25.91 28.02 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.695 2.263 . . . . 64.41 112.387 179.902 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.49 ' HG ' HG22 ' A' ' 10' ' ' ILE . 2.1 tt -87.13 -19.33 28.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 72.14 110.973 179.902 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.549 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -52.43 -28.4 19.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 74.44 111.118 179.742 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -106.6 -32.25 8.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 54.43 110.908 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.49 HG22 ' HG ' ' A' ' 7' ' ' LEU . 3.0 tp -52.06 -26.47 8.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 53.45 111.208 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.7 pt -65.37 -36.03 76.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.114 -0.494 . . . . 72.33 111.189 179.781 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -89.03 -28.3 20.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.189 -0.46 . . . . 72.21 111.078 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.07 -36.18 79.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.309 -0.405 . . . . 61.44 110.843 179.96 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.7 tp -65.08 -26.55 40.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 73.32 111.206 179.953 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -86.79 -9.92 54.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.088 -0.505 . . . . 73.4 110.893 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -103.54 -39.24 6.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.125 -0.489 . . . . 75.33 110.905 -179.917 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.4 tp -75.96 -31.05 21.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 74.43 111.138 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -112.66 -21.63 11.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.154 -0.475 . . . . 62.43 111.134 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.36 0 C-N-CA 120.73 -0.747 . . . . 54.33 112.476 -179.935 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.771 0.319 . . . . 74.21 110.862 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.4 ttm -77.37 -4.38 44.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.449 . . . . 74.43 110.853 179.946 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.804 HD12 HD13 ' A' ' 7' ' ' LEU . 41.5 tp -107.69 -11.72 15.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.439 . . . . 74.2 110.957 179.945 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.459 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.0 mm? -106.86 -20.14 13.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.204 -0.453 . . . . 62.44 110.899 179.905 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.538 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -73.17 -57.92 2.67 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.596 0.713 . . . . 75.33 111.14 179.943 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.688 ' HG2' HD12 ' A' ' 7' ' ' LEU . 53.8 Cg_endo -69.84 -23.88 29.95 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.634 2.222 . . . . 64.41 112.34 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.804 HD13 HD12 ' A' ' 3' ' ' LEU . 5.3 mp -106.51 5.87 29.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.454 . . . . 72.14 110.951 179.913 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.459 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -47.73 -51.92 20.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 74.44 111.053 179.804 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.632 ' H ' HD13 ' A' ' 10' ' ' ILE . 0.0 OUTLIER 179.7 33.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 54.43 110.869 179.993 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.632 HD13 ' H ' ' A' ' 9' ' ' LYS . 0.1 OUTLIER -128.45 27.73 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 53.45 111.159 179.859 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.711 HD12 ' HA ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -114.79 13.7 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.486 . . . . 72.33 111.135 179.899 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -178.86 -34.0 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.134 -0.485 . . . . 72.21 111.017 179.829 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 17.6 t60 -59.86 -19.09 49.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.267 -0.424 . . . . 61.44 110.774 -179.92 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.504 HD13 ' H ' ' A' ' 14' ' ' ILE . 0.1 OUTLIER -125.99 4.66 4.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 73.32 111.13 -179.935 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.58 -17.86 14.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.174 -0.466 . . . . 73.4 110.913 179.966 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -111.97 -29.48 7.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.473 . . . . 75.33 110.857 -179.894 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.481 HG22 ' HA ' ' A' ' 14' ' ' ILE . 10.8 tp -74.17 -29.67 25.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 74.43 111.171 179.967 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -117.02 -20.46 9.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.113 -0.494 . . . . 62.43 111.065 179.832 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 C-N-CA 120.713 -0.756 . . . . 54.33 112.484 -179.973 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.778 0.323 . . . . 74.21 110.831 . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -59.76 -18.45 43.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.153 -0.476 . . . . 74.43 110.897 179.932 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.9 mt -102.24 0.92 35.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 74.2 110.913 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.415 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 mm? -112.25 -22.16 11.07 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.231 -0.44 . . . . 62.44 110.889 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.48 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -73.5 -60.86 1.55 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.575 0.702 . . . . 75.33 111.155 179.884 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.5 Cg_endo -69.72 -18.39 37.23 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.687 2.258 . . . . 64.41 112.375 179.905 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.451 HD23 HG21 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -112.57 7.98 19.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.267 -0.424 . . . . 72.14 110.962 179.911 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -47.1 -67.03 0.32 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 74.44 111.032 179.805 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.0 35.74 0.21 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.263 -0.426 . . . . 54.43 110.878 179.956 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.776 HG22 HD13 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -122.62 2.83 5.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 53.45 111.153 179.82 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.451 HG21 HD23 ' A' ' 7' ' ' LEU . 1.5 pt -66.09 -36.5 77.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 72.33 111.121 179.849 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -137.83 -39.05 0.56 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 72.21 111.081 179.867 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -57.34 -33.52 67.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 61.44 110.825 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.776 HD13 HG22 ' A' ' 10' ' ' ILE . 2.3 tp -57.79 -26.81 28.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 73.32 111.162 179.989 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 -89.68 -10.23 46.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 73.4 110.879 179.949 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -100.66 -30.17 11.9 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.16 -0.473 . . . . 75.33 110.908 -179.958 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.586 HD11 HD12 ' A' ' 14' ' ' ILE . 24.5 pt -89.32 -31.68 5.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.172 -0.467 . . . . 74.43 111.126 179.951 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.12 -22.02 19.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.436 . . . . 62.43 111.102 179.766 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.235 0 C-N-CA 120.771 -0.728 . . . . 54.33 112.439 -179.951 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.656 ' HG2' HD11 ' A' ' 4' ' ' LEU . 3.5 mtm180 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.788 0.328 . . . . 74.209999999999994 110.869 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.86 -2.23 57.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 74.430000000000007 110.875 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.493 ' O ' HD22 ' A' ' 7' ' ' LEU . 19.0 mt -105.59 -19.46 13.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.254 -0.43 . . . . 74.200000000000003 110.94 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.656 HD11 ' HG2' ' A' ' 1' ' ' ARG . 3.4 pp -101.56 -20.48 15.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.204 -0.453 . . . . 62.439999999999998 110.904 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.539 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -69.91 -57.2 6.6 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.595 0.712 . . . . 75.329999999999998 111.142 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.539 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.75 -28.32 25.43 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.642 2.228 . . . . 64.409999999999997 112.353 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.493 HD22 ' O ' ' A' ' 3' ' ' LEU . 9.9 mp -83.73 -23.85 31.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.246 -0.434 . . . . 72.140000000000001 110.934 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.528 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -51.89 -29.79 21.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 74.439999999999998 111.028 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -63.35 1.41 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 54.43 110.833 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.0 tp -51.34 -27.76 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 53.450000000000003 111.132 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.451 HG22 ' O ' ' A' ' 8' ' ' ALA . 2.5 tp -55.2 -26.68 18.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.212 -0.449 . . . . 72.329999999999998 111.108 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.209999999999994 111.079 179.768 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.774 0.321 . . . . 74.209999999999994 110.85 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -18.7 46.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.202 -0.454 . . . . 74.430000000000007 110.894 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.614 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -100.86 -0.26 37.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 74.200000000000003 110.869 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.557 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.2 mm? -111.78 -24.06 10.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.197 -0.456 . . . . 62.439999999999998 110.969 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.503 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -69.5 -59.69 4.61 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 121.568 0.699 . . . . 75.329999999999998 111.143 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.1 Cg_endo -69.76 -23.62 30.6 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.668 2.245 . . . . 64.409999999999997 112.334 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.614 HD13 ' O ' ' A' ' 3' ' ' LEU . 8.6 mp -89.51 -18.76 26.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.245 -0.434 . . . . 72.140000000000001 110.941 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.557 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -54.51 -26.01 29.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.161 -0.472 . . . . 74.439999999999998 111.058 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -74.06 -62.57 1.46 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 54.43 110.865 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.0 pt -61.66 -21.34 25.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.256 -0.429 . . . . 53.450000000000003 111.099 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.461 HG22 ' O ' ' A' ' 8' ' ' ALA . 2.6 tp -52.21 -26.51 8.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.18 -0.464 . . . . 72.329999999999998 111.108 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 72.209999999999994 111.097 179.816 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.6 mtm-85 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.804 0.335 . . . . 74.209999999999994 110.866 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 22.4 mtt -64.26 -14.52 56.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 74.430000000000007 110.885 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt -101.23 -10.72 20.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 74.200000000000003 110.916 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.5 mt -98.79 -25.69 14.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.149 -0.478 . . . . 62.439999999999998 110.922 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.495 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -67.44 -59.61 6.87 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.538 0.685 . . . . 75.329999999999998 111.058 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.553 ' O ' HG23 ' A' ' 10' ' ' ILE . 53.8 Cg_endo -69.78 -21.19 33.75 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.611 2.207 . . . . 64.409999999999997 112.388 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.3 tt -87.53 -17.29 32.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 72.140000000000001 110.941 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -88.74 15.06 8.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 74.439999999999998 111.1 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -144.08 14.84 1.69 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.135 -0.484 . . . . 54.43 110.889 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.553 HG23 ' O ' ' A' ' 6' ' ' PRO . 2.9 pp -117.08 -23.57 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.271 -0.422 . . . . 53.450000000000003 111.197 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.531 ' N ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -65.86 -17.16 21.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 72.329999999999998 111.117 179.861 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 72.209999999999994 111.135 179.735 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.709 0.29 . . . . 74.209999999999994 110.828 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 mtt -59.91 -18.26 43.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 74.430000000000007 110.899 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.551 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -101.82 0.27 35.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 74.200000000000003 110.912 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 11.2 mt -112.11 -22.04 11.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.137 -0.483 . . . . 62.439999999999998 110.926 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.489 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -72.75 -60.49 1.94 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.62 0.724 . . . . 75.329999999999998 111.185 179.877 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.734 ' HG2' HD12 ' A' ' 7' ' ' LEU . 53.4 Cg_endo -69.83 -20.48 34.47 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.641 2.227 . . . . 64.409999999999997 112.296 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.734 HD12 ' HG2' ' A' ' 6' ' ' PRO . 4.1 mp -109.24 6.5 24.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 72.140000000000001 110.93 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -47.25 -52.4 16.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.446 . . . . 74.439999999999998 111.16 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.677 ' H ' HD13 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -179.89 36.79 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 54.43 110.944 179.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.677 HD13 ' H ' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -125.54 19.08 4.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 53.450000000000003 111.154 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.507 HD13 ' H ' ' A' ' 11' ' ' ILE . 0.1 OUTLIER -135.86 6.29 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 72.329999999999998 111.131 179.835 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 72.209999999999994 111.098 179.807 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.526 0.055 0 CA-C-O 120.728 0.299 . . . . 74.209999999999994 110.835 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.5 ttt -72.98 -8.27 54.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 74.430000000000007 110.916 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 30.6 tp -102.67 -19.86 14.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.227 -0.442 . . . . 74.200000000000003 110.858 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.528 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.2 mm? -93.79 -23.84 18.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 62.439999999999998 110.85 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.531 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -67.89 -57.93 8.83 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.63 0.729 . . . . 75.329999999999998 111.164 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.67 -25.49 28.97 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.722 2.281 . . . . 64.409999999999997 112.36 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.498 ' HG ' HG22 ' A' ' 10' ' ' ILE . 0.9 OUTLIER -88.17 -19.6 26.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 72.140000000000001 110.964 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.528 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -54.54 -26.43 31.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.466 . . . . 74.439999999999998 111.099 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -107.56 -30.23 8.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.435 . . . . 54.43 110.892 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.498 HG22 ' HG ' ' A' ' 7' ' ' LEU . 2.7 tp -54.93 -25.04 15.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 53.450000000000003 111.152 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.6 pt -64.97 -15.12 17.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.48 . . . . 72.329999999999998 111.071 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 72.209999999999994 111.123 179.791 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.769 0.318 . . . . 74.209999999999994 110.856 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -63.78 -15.86 59.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 74.430000000000007 110.903 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.559 ' O ' HD22 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -102.85 -4.29 25.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 74.200000000000003 110.907 -179.941 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 16.5 mt -106.6 -24.62 12.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 62.439999999999998 110.958 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.537 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -70.0 -57.79 5.9 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 121.548 0.69 . . . . 75.329999999999998 111.116 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.75 -19.9 35.57 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.717 2.278 . . . . 64.409999999999997 112.291 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.559 HD22 ' O ' ' A' ' 3' ' ' LEU . 11.0 mp -89.56 -19.95 24.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.258 -0.428 . . . . 72.140000000000001 110.933 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.64 16.55 11.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.449 . . . . 74.439999999999998 111.061 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.09 -32.35 3.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 54.43 110.945 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.9 pt -72.04 -35.15 52.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 53.450000000000003 111.135 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.7 pt -59.8 -19.19 16.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 72.329999999999998 111.158 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.17 -0.468 . . . . 72.209999999999994 111.133 179.785 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.2 mpp_? . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.868 0.366 . . . . 74.209999999999994 110.86 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.2 ptp -72.51 -8.64 56.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 74.430000000000007 110.917 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.9 -19.66 14.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.446 . . . . 74.200000000000003 110.94 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -92.62 -24.59 18.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 62.439999999999998 110.928 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.54 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -67.85 -57.79 9.13 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.535 0.683 . . . . 75.329999999999998 111.103 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.71 -23.44 31.03 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.669 2.246 . . . . 64.409999999999997 112.335 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.538 ' O ' HG23 ' A' ' 11' ' ' ILE . 0.7 OUTLIER -84.99 -20.6 30.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 72.140000000000001 110.933 -179.992 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -89.25 11.96 17.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 74.439999999999998 111.107 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.6 mmmt -136.94 9.34 3.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 54.43 110.928 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.538 HG23 ' O ' ' A' ' 6' ' ' PRO . 2.8 pp -117.51 -18.64 6.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 53.450000000000003 111.158 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.538 HG23 ' O ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -61.92 -16.15 15.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.149 -0.478 . . . . 72.329999999999998 111.104 179.82 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.243 -0.435 . . . . 72.209999999999994 111.094 179.813 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.878 0.371 . . . . 74.209999999999994 110.874 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.23 -15.92 50.12 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.201 -0.454 . . . . 74.430000000000007 110.941 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.38 -6.63 22.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 74.200000000000003 110.926 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.413 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 15.9 mt -103.16 -21.81 13.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 62.439999999999998 110.909 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.471 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -73.05 -60.97 1.64 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.64 0.733 . . . . 75.329999999999998 111.199 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.559 ' HA ' HD11 ' A' ' 10' ' ' ILE . 53.8 Cg_endo -69.81 -17.08 37.57 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.692 2.261 . . . . 64.409999999999997 112.336 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.512 HD23 HD11 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -112.43 5.61 18.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 72.140000000000001 110.94 179.964 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -47.03 -55.13 8.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 74.439999999999998 111.113 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.96 31.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.24 -0.436 . . . . 54.43 110.879 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.559 HD11 ' HA ' ' A' ' 6' ' ' PRO . 0.6 OUTLIER -114.04 11.46 8.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.249 -0.432 . . . . 53.450000000000003 111.1 179.889 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.52 HD13 ' H ' ' A' ' 11' ' ' ILE . 0.1 OUTLIER -133.95 4.8 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.474 . . . . 72.329999999999998 111.134 179.877 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.467 . . . . 72.209999999999994 111.117 179.79 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.444 ' CG ' HD21 ' A' ' 4' ' ' LEU . 8.5 mtt180 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.815 0.34 . . . . 74.209999999999994 110.891 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.8 mtt -80.3 -1.32 40.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.218 -0.446 . . . . 74.430000000000007 110.874 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 39.7 tp -105.2 -26.72 11.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 74.200000000000003 110.928 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.531 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 pp -90.33 -22.92 21.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 62.439999999999998 110.921 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.529 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.01 -58.02 8.5 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.589 0.709 . . . . 75.329999999999998 111.145 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.7 Cg_endo -69.77 -25.53 28.47 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.643 2.228 . . . . 64.409999999999997 112.363 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.5 ' HG ' HG22 ' A' ' 10' ' ' ILE . 0.8 OUTLIER -87.56 -21.23 25.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 72.140000000000001 110.947 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -52.81 -28.29 21.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 74.439999999999998 111.106 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.25 -31.82 8.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 54.43 110.888 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.5 HG22 ' HG ' ' A' ' 7' ' ' LEU . 2.9 tp -52.55 -26.42 9.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 53.450000000000003 111.177 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.6 pt -65.96 -34.08 67.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 72.329999999999998 111.104 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.227 -0.442 . . . . 72.209999999999994 111.07 179.838 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.133 0 CA-C-O 120.78 0.324 . . . . 74.209999999999994 110.925 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.7 ttp -64.8 -13.93 57.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 74.430000000000007 110.929 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 41.3 tp -100.6 -13.42 18.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 74.200000000000003 110.916 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.518 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.2 mm? -96.61 -25.09 15.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.152 -0.476 . . . . 62.439999999999998 110.873 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.492 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -66.99 -59.62 7.36 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 121.52 0.676 . . . . 75.329999999999998 111.178 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.5 Cg_endo -69.79 -22.53 31.79 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.72 2.28 . . . . 64.409999999999997 112.327 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.635 ' O ' HG23 ' A' ' 11' ' ' ILE . 0.7 OUTLIER -90.62 -17.04 27.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 72.140000000000001 110.923 179.986 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.518 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -59.49 -19.95 51.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 74.439999999999998 111.057 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.3 mptt -119.77 -27.1 5.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.248 -0.433 . . . . 54.43 110.856 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.7 tp -54.45 -27.23 17.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.281 -0.418 . . . . 53.450000000000003 111.119 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.635 HG23 ' O ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -62.64 -16.13 16.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 72.329999999999998 111.142 179.829 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.167 -0.47 . . . . 72.209999999999994 111.161 179.791 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.492 ' HG3' HD22 ' A' ' 4' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.775 0.322 . . . . 74.209999999999994 110.872 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -11.04 60.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 74.430000000000007 110.867 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.48 -14.7 16.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 74.200000000000003 111.006 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.515 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 0.1 OUTLIER -96.43 -26.03 15.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 62.439999999999998 110.902 179.832 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.525 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -66.93 -57.79 10.71 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.572 0.701 . . . . 75.329999999999998 111.179 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.79 -24.37 29.6 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.719 2.28 . . . . 64.409999999999997 112.341 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.6 ' O ' HG23 ' A' ' 11' ' ' ILE . 3.8 tt -89.14 -17.96 28.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.21 -0.45 . . . . 72.140000000000001 110.89 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.515 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -59.61 -20.28 54.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 74.439999999999998 111.069 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -119.23 -26.69 5.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 54.43 110.948 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.4 HG22 ' HG ' ' A' ' 7' ' ' LEU . 2.7 tp -54.73 -26.14 16.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 53.450000000000003 111.105 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.6 HG23 ' O ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -63.78 -14.49 15.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 72.329999999999998 111.11 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 72.209999999999994 111.074 179.843 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.445 ' HG2' HD21 ' A' ' 4' ' ' LEU . 6.3 mtm180 . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 120.776 0.322 . . . . 74.209999999999994 110.877 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.26 -1.35 40.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.473 . . . . 74.430000000000007 110.96 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.14 -26.67 11.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 74.200000000000003 110.96 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 pp -90.3 -22.9 21.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 62.439999999999998 110.94 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.526 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.02 -58.0 8.5 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.655 0.74 . . . . 75.329999999999998 111.146 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.74 -25.53 28.58 Favored 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.742 2.295 . . . . 64.409999999999997 112.353 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.5 tt -86.45 -19.09 30.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.231 -0.44 . . . . 72.140000000000001 110.947 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.521 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -62.56 -16.75 57.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.461 . . . . 74.439999999999998 111.066 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.4 pttt -114.37 -24.39 8.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.211 -0.45 . . . . 54.43 110.891 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.5 tp -58.37 -21.54 18.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.243 -0.435 . . . . 53.450000000000003 111.111 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -103.14 4.74 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.466 . . . . 72.329999999999998 111.12 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 72.209999999999994 111.087 179.86 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.775 0.321 . . . . 74.209999999999994 110.921 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.8 ttm -72.96 -8.33 55.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 74.430000000000007 110.882 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.74 -19.42 14.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 74.200000000000003 110.933 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.529 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 13.4 mt -94.77 -23.13 17.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.247 -0.433 . . . . 62.439999999999998 110.917 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.522 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.51 -57.88 7.89 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 121.599 0.714 . . . . 75.329999999999998 111.184 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.522 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.4 Cg_endo -69.85 -25.84 27.77 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.7 2.267 . . . . 64.409999999999997 112.307 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.2 tp -88.85 -18.48 27.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 72.140000000000001 110.946 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -51.32 -30.56 18.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.18 -0.464 . . . . 74.439999999999998 111.133 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -62.88 1.5 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 54.43 110.918 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.51 -26.14 9.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.269 -0.423 . . . . 53.450000000000003 111.12 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.43 HG22 ' O ' ' A' ' 8' ' ' ALA . 2.7 tp -52.53 -26.25 9.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 72.329999999999998 111.101 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 72.209999999999994 111.156 179.746 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.815 0.341 . . . . 74.209999999999994 110.868 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -64.14 -14.79 57.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 74.430000000000007 110.879 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 mt -101.57 -9.72 20.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.194 -0.457 . . . . 74.200000000000003 110.923 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 21.6 mt -99.63 -25.43 14.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.175 -0.466 . . . . 62.439999999999998 110.917 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.505 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -68.33 -59.5 5.99 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.573 0.702 . . . . 75.329999999999998 111.162 179.96 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.505 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.7 -20.47 35.07 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.746 2.297 . . . . 64.409999999999997 112.356 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 28.1 tp -87.11 -21.06 26.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.223 -0.444 . . . . 72.140000000000001 110.977 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -90.88 43.75 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 74.439999999999998 111.089 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -168.62 -42.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 54.43 110.855 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.7 tp -55.01 -27.13 18.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.269 -0.423 . . . . 53.450000000000003 111.153 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.434 ' N ' HD13 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -64.97 -15.42 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 72.329999999999998 111.046 179.878 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 72.209999999999994 111.076 179.882 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.7 ttt180 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.762 0.315 . . . . 74.209999999999994 110.876 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -72.6 -8.63 56.23 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.231 -0.44 . . . . 74.430000000000007 110.859 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 11.4 mt -102.75 -19.53 14.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.235 -0.439 . . . . 74.200000000000003 110.939 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -93.37 -24.27 18.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.197 -0.456 . . . . 62.439999999999998 110.902 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.531 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -67.83 -57.87 9.02 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.582 0.706 . . . . 75.329999999999998 111.116 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.73 -23.96 30.33 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.705 2.27 . . . . 64.409999999999997 112.368 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.63 ' HG ' HD13 ' A' ' 11' ' ' ILE . 1.0 OUTLIER -84.45 -24.55 29.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.454 . . . . 72.140000000000001 110.909 179.944 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.91 -18.31 60.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 74.439999999999998 111.117 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -92.6 -2.11 56.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 54.43 110.924 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.443 HD12 ' C ' ' A' ' 10' ' ' ILE . 2.9 pp -128.0 -1.38 3.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 53.450000000000003 111.208 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.63 HD13 ' HG ' ' A' ' 7' ' ' LEU . 1.2 tp -79.78 -26.55 12.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.12 -0.491 . . . . 72.329999999999998 111.068 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 72.209999999999994 111.149 179.821 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.408 ' CG ' HD21 ' A' ' 4' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.75 0.31 . . . . 74.209999999999994 110.813 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -81.11 -0.7 41.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 74.430000000000007 110.83 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.5 mt -105.56 -26.88 11.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.445 . . . . 74.200000000000003 110.921 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.531 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 pp -90.61 -22.74 21.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 62.439999999999998 110.969 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.531 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.31 -58.0 8.04 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.58 0.705 . . . . 75.329999999999998 111.1 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.4 Cg_endo -69.74 -25.54 28.57 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.762 2.308 . . . . 64.409999999999997 112.347 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.67 -21.68 25.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 72.140000000000001 110.985 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -51.41 -30.54 19.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 74.439999999999998 111.092 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -76.23 -59.78 2.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 54.43 111.0 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.53 -26.16 9.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 53.450000000000003 111.196 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.403 HG22 ' O ' ' A' ' 8' ' ' ALA . 2.7 tp -52.5 -26.19 9.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 72.329999999999998 111.169 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.154 -0.476 . . . . 72.209999999999994 111.091 179.794 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.739 0.305 . . . . 74.209999999999994 110.858 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.2 ttm -66.88 -13.42 61.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.453 . . . . 74.430000000000007 110.869 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.41 -9.2 20.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.294 -0.412 . . . . 74.200000000000003 110.841 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -103.86 -23.57 13.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.212 -0.449 . . . . 62.439999999999998 110.942 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.538 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -69.16 -57.57 7.24 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.594 0.711 . . . . 75.329999999999998 111.123 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.81 -24.64 29.22 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.703 2.269 . . . . 64.409999999999997 112.282 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.841 HD13 HD11 ' A' ' 10' ' ' ILE . 3.7 mm? -82.05 -29.41 31.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.249 -0.432 . . . . 72.140000000000001 110.959 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.13 58.73 1.61 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 74.439999999999998 111.115 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -178.7 -49.31 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.248 -0.433 . . . . 54.43 110.915 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.841 HD11 HD13 ' A' ' 7' ' ' LEU . 2.4 pt -64.43 -13.5 14.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 53.450000000000003 111.155 179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.412 HG23 ' O ' ' A' ' 7' ' ' LEU . 2.0 pt -58.33 -19.27 13.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 72.329999999999998 111.152 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.449 . . . . 72.209999999999994 111.129 179.793 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.782 0.325 . . . . 74.209999999999994 110.9 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 33.1 ttm -70.03 -10.74 59.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 74.430000000000007 110.846 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 48.9 mt -102.65 -15.49 16.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 74.200000000000003 110.914 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.89 -26.51 16.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.175 -0.466 . . . . 62.439999999999998 110.955 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.525 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -66.8 -57.66 11.23 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.548 0.69 . . . . 75.329999999999998 111.121 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.79 -22.95 31.24 Favored 'Trans proline' 0 N--CA 1.464 -0.232 0 C-N-CA 122.691 2.261 . . . . 64.409999999999997 112.386 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.6 tt -85.78 -21.55 28.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 72.140000000000001 110.915 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -83.52 3.98 29.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.233 -0.439 . . . . 74.439999999999998 111.088 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.56 -37.7 5.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 54.43 110.889 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.3 pt -67.65 -28.41 41.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 53.450000000000003 111.118 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.7 pt -87.47 43.14 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.208 -0.451 . . . . 72.329999999999998 111.134 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 72.209999999999994 111.064 179.828 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.592 ' HG2' HD11 ' A' ' 4' ' ' LEU . 2.5 mtt180 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.872 0.368 . . . . 74.209999999999994 110.887 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.5 ptt? -85.73 -1.39 57.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.445 . . . . 74.430000000000007 110.884 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 84.6 mt -106.46 -20.29 13.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.243 -0.435 . . . . 74.200000000000003 110.888 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.592 HD11 ' HG2' ' A' ' 1' ' ' ARG . 3.5 pp -99.89 -21.04 15.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.235 -0.438 . . . . 62.439999999999998 110.943 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.541 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -70.05 -57.2 6.41 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.553 0.692 . . . . 75.329999999999998 111.155 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.72 -26.79 27.41 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.681 2.254 . . . . 64.409999999999997 112.354 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.733 ' O ' HG23 ' A' ' 11' ' ' ILE . 3.9 mm? -80.68 -24.05 39.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 72.140000000000001 110.961 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -81.52 0.18 39.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.45 . . . . 74.439999999999998 111.052 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.22 2.08 13.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.291 -0.413 . . . . 54.43 110.907 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.465 HD12 ' C ' ' A' ' 10' ' ' ILE . 2.9 pp -121.43 -10.62 9.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 53.450000000000003 111.174 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.733 HG23 ' O ' ' A' ' 7' ' ' LEU . 2.7 pp -63.04 -15.65 16.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.142 -0.481 . . . . 72.329999999999998 111.159 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.693 ' N ' HD12 ' A' ' 11' ' ' ILE . . . . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 72.209999999999994 111.088 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.615 ' HG2' HD22 ' A' ' 4' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.792 0.33 . . . . 74.209999999999994 110.855 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.2 mtt -60.78 -18.09 53.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 74.430000000000007 110.938 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.483 ' O ' HD23 ' A' ' 7' ' ' LEU . 6.4 mt -101.43 -0.73 34.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 74.200000000000003 110.856 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.615 HD22 ' HG2' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -109.93 -25.92 10.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.242 -0.436 . . . . 62.439999999999998 110.879 179.969 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.494 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -68.61 -59.58 5.59 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 121.592 0.711 . . . . 75.329999999999998 111.175 179.92 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.74 -21.68 33.24 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.722 2.281 . . . . 64.409999999999997 112.366 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.483 HD23 ' O ' ' A' ' 3' ' ' LEU . 4.5 mm? -86.62 -21.58 26.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 72.140000000000001 110.896 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.99 58.02 1.44 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 74.439999999999998 111.094 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -166.15 -48.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 54.43 110.869 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -88.89 -1.4 8.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 53.450000000000003 111.107 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.545 HD12 ' C ' ' A' ' 11' ' ' ILE . 2.8 pp -91.39 14.35 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 72.329999999999998 111.141 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 72.209999999999994 111.087 179.861 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.094 0 CA-C-O 120.812 0.339 . . . . 74.209999999999994 110.841 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 mtm -67.83 -12.73 61.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.167 -0.47 . . . . 74.430000000000007 110.86 179.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.478 ' O ' HD13 ' A' ' 7' ' ' LEU . 7.2 mt -104.13 -6.69 20.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.28 -0.418 . . . . 74.200000000000003 110.901 -179.975 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.426 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 13.2 mt -108.17 -20.51 13.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 62.439999999999998 110.922 179.881 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.524 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -73.16 -58.33 2.52 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.544 0.688 . . . . 75.329999999999998 111.184 179.91 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.69 ' HG2' HD12 ' A' ' 7' ' ' LEU . 54.3 Cg_endo -69.73 -23.71 30.63 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.711 2.274 . . . . 64.409999999999997 112.387 179.873 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.69 HD12 ' HG2' ' A' ' 6' ' ' PRO . 3.8 mp -107.16 6.63 28.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 72.140000000000001 110.915 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.507 ' HB1' ' HD3' ' A' ' 9' ' ' LYS . . . -46.67 -53.24 12.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.471 . . . . 74.439999999999998 111.137 179.79 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.507 ' HD3' ' HB1' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -179.46 36.23 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.465 . . . . 54.43 110.917 179.997 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.483 HD11 ' HA ' ' A' ' 6' ' ' PRO . 0.5 OUTLIER -125.16 18.95 4.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 53.450000000000003 111.122 179.851 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.507 HD13 ' H ' ' A' ' 11' ' ' ILE . 0.1 OUTLIER -135.53 6.19 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.19 -0.459 . . . . 72.329999999999998 111.134 179.851 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.493 . . . . 72.209999999999994 111.16 179.796 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.825 0.345 . . . . 74.209999999999994 110.934 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 27.7 mtm -64.16 -15.68 60.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 74.430000000000007 110.873 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.432 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -102.07 -4.96 25.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.231 -0.44 . . . . 74.200000000000003 110.916 -179.977 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.513 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 mm? -108.22 -23.56 11.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 62.439999999999998 110.82 179.962 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.53 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -69.69 -57.93 6.15 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.672 0.749 . . . . 75.329999999999998 111.146 179.988 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.1 Cg_endo -69.73 -25.41 28.78 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.65 2.234 . . . . 64.409999999999997 112.379 179.913 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.432 HD23 ' O ' ' A' ' 3' ' ' LEU . 4.5 mm? -85.6 -21.73 28.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 72.140000000000001 110.881 -179.982 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.513 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -62.14 -20.72 64.39 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.169 -0.468 . . . . 74.439999999999998 111.08 179.825 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.0 -29.26 11.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 54.43 110.906 179.976 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.22 -26.98 9.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.221 -0.445 . . . . 53.450000000000003 111.146 179.816 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.6 pt -67.02 -35.71 75.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 72.329999999999998 111.141 179.901 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 72.209999999999994 111.101 179.812 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.469 ' HA ' HD21 ' A' ' 4' ' ' LEU . 10.7 ttt180 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.789 0.328 . . . . 74.209999999999994 110.869 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -84.17 4.64 29.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 74.430000000000007 110.931 179.968 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.77 -5.94 13.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.48 . . . . 74.200000000000003 110.933 -179.971 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.549 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.57 -23.94 10.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 62.439999999999998 110.951 179.897 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.496 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -68.34 -59.5 5.98 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.547 0.689 . . . . 75.329999999999998 111.174 179.896 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.2 Cg_endo -69.78 -25.91 28.02 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.695 2.263 . . . . 64.409999999999997 112.387 179.902 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.49 ' HG ' HG22 ' A' ' 10' ' ' ILE . 2.1 tt -87.13 -19.33 28.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 72.140000000000001 110.973 179.902 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.549 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -52.43 -28.4 19.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 74.439999999999998 111.118 179.742 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -106.6 -32.25 8.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 54.43 110.908 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.49 HG22 ' HG ' ' A' ' 7' ' ' LEU . 3.0 tp -52.06 -26.47 8.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 53.450000000000003 111.208 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.7 pt -65.37 -36.03 76.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.114 -0.494 . . . . 72.329999999999998 111.189 179.781 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.189 -0.46 . . . . 72.209999999999994 111.078 179.808 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.771 0.319 . . . . 74.209999999999994 110.862 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.4 ttm -77.37 -4.38 44.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.449 . . . . 74.430000000000007 110.853 179.946 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.804 HD12 HD13 ' A' ' 7' ' ' LEU . 41.5 tp -107.69 -11.72 15.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.439 . . . . 74.200000000000003 110.957 179.945 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.459 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.0 mm? -106.86 -20.14 13.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.204 -0.453 . . . . 62.439999999999998 110.899 179.905 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.538 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -73.17 -57.92 2.67 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.596 0.713 . . . . 75.329999999999998 111.14 179.943 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.688 ' HG2' HD12 ' A' ' 7' ' ' LEU . 53.8 Cg_endo -69.84 -23.88 29.95 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.634 2.222 . . . . 64.409999999999997 112.34 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.804 HD13 HD12 ' A' ' 3' ' ' LEU . 5.3 mp -106.51 5.87 29.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.454 . . . . 72.140000000000001 110.951 179.913 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.459 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -47.73 -51.92 20.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 74.439999999999998 111.053 179.804 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.632 ' H ' HD13 ' A' ' 10' ' ' ILE . 0.0 OUTLIER 179.7 33.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 54.43 110.869 179.993 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.632 HD13 ' H ' ' A' ' 9' ' ' LYS . 0.1 OUTLIER -128.45 27.73 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 53.450000000000003 111.159 179.859 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.711 HD12 ' HA ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -114.79 13.7 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.486 . . . . 72.329999999999998 111.135 179.899 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.134 -0.485 . . . . 72.209999999999994 111.017 179.829 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.778 0.323 . . . . 74.209999999999994 110.831 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -59.76 -18.45 43.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.153 -0.476 . . . . 74.430000000000007 110.897 179.932 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.9 mt -102.24 0.92 35.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 74.200000000000003 110.913 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.415 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 mm? -112.25 -22.16 11.07 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.231 -0.44 . . . . 62.439999999999998 110.889 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.48 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -73.5 -60.86 1.55 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.575 0.702 . . . . 75.329999999999998 111.155 179.884 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.5 Cg_endo -69.72 -18.39 37.23 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.687 2.258 . . . . 64.409999999999997 112.375 179.905 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.451 HD23 HG21 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -112.57 7.98 19.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.267 -0.424 . . . . 72.140000000000001 110.962 179.911 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -47.1 -67.03 0.32 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 74.439999999999998 111.032 179.805 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.0 35.74 0.21 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.263 -0.426 . . . . 54.43 110.878 179.956 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.477 HD11 ' HA ' ' A' ' 6' ' ' PRO . 0.5 OUTLIER -122.62 2.83 5.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 53.450000000000003 111.153 179.82 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.451 HG21 HD23 ' A' ' 7' ' ' LEU . 1.5 pt -66.09 -36.5 77.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 72.329999999999998 111.121 179.849 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 72.209999999999994 111.081 179.867 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.656 ' HG2' HD11 ' A' ' 4' ' ' LEU . 3.5 mtm180 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.788 0.328 . . . . 74.209999999999994 110.869 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.86 -2.23 57.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 74.430000000000007 110.875 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.493 ' O ' HD22 ' A' ' 7' ' ' LEU . 19.0 mt -105.59 -19.46 13.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.254 -0.43 . . . . 74.200000000000003 110.94 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.656 HD11 ' HG2' ' A' ' 1' ' ' ARG . 3.4 pp -101.56 -20.48 15.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.204 -0.453 . . . . 62.439999999999998 110.904 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.539 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -69.91 -57.2 6.6 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.595 0.712 . . . . 75.329999999999998 111.142 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.539 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.75 -28.32 25.43 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.642 2.228 . . . . 64.409999999999997 112.353 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.493 HD22 ' O ' ' A' ' 3' ' ' LEU . 9.9 mp -83.73 -23.85 31.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.246 -0.434 . . . . 72.140000000000001 110.934 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.528 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -51.89 -29.79 21.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 74.439999999999998 111.028 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -63.35 1.41 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 54.43 110.833 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.0 tp -51.34 -27.76 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 53.450000000000003 111.132 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.451 HG22 ' O ' ' A' ' 8' ' ' ALA . 2.5 tp -55.2 -26.68 18.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.212 -0.449 . . . . 72.329999999999998 111.108 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -129.31 -0.85 5.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.209999999999994 111.079 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -90.08 4.47 50.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.265 -0.425 . . . . 61.439999999999998 110.825 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.467 HD12 ' C ' ' A' ' 14' ' ' ILE . 2.9 pp -121.57 -10.25 9.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.235 -0.439 . . . . 73.319999999999993 111.145 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -94.9 -20.68 19.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 73.400000000000006 110.948 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.31 -33.51 12.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.07 -0.514 . . . . 75.329999999999998 110.903 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.44 HD12 ' N ' ' A' ' 18' ' ' ALA . 2.5 pp -79.71 -32.51 14.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.165 -0.47 . . . . 74.430000000000007 111.106 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.44 ' N ' HD12 ' A' ' 17' ' ' ILE . . . -105.08 -22.9 13.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 62.43 111.124 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 C-N-CA 120.67 -0.776 . . . . 54.329999999999998 112.512 -179.957 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.774 0.321 . . . . 74.209999999999994 110.85 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -18.7 46.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.202 -0.454 . . . . 74.430000000000007 110.894 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.614 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -100.86 -0.26 37.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 74.200000000000003 110.869 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.557 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.2 mm? -111.78 -24.06 10.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.197 -0.456 . . . . 62.439999999999998 110.969 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.503 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -69.5 -59.69 4.61 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 121.568 0.699 . . . . 75.329999999999998 111.143 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.1 Cg_endo -69.76 -23.62 30.6 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.668 2.245 . . . . 64.409999999999997 112.334 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.614 HD13 ' O ' ' A' ' 3' ' ' LEU . 8.6 mp -89.51 -18.76 26.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.245 -0.434 . . . . 72.140000000000001 110.941 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.557 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -54.51 -26.01 29.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.161 -0.472 . . . . 74.439999999999998 111.058 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -74.06 -62.57 1.46 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 54.43 110.865 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.0 pt -61.66 -21.34 25.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.256 -0.429 . . . . 53.450000000000003 111.099 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.461 HG22 ' O ' ' A' ' 8' ' ' ALA . 2.6 tp -52.21 -26.51 8.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.18 -0.464 . . . . 72.329999999999998 111.108 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -119.85 -31.54 4.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 72.209999999999994 111.097 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -51.89 -40.98 61.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.248 -0.433 . . . . 61.439999999999998 110.832 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.5 pt -68.69 -36.33 73.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 73.319999999999993 111.097 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.43 -16.62 59.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 73.400000000000006 110.869 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -89.41 -37.39 14.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 75.329999999999998 110.928 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 25.6 pt -84.6 -31.77 7.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 74.430000000000007 111.114 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -98.64 -21.99 16.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 62.43 111.082 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 C-N-CA 120.724 -0.75 . . . . 54.329999999999998 112.471 -179.953 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.6 mtm-85 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.804 0.335 . . . . 74.209999999999994 110.866 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 22.4 mtt -64.26 -14.52 56.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 74.430000000000007 110.885 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt -101.23 -10.72 20.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 74.200000000000003 110.916 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.5 mt -98.79 -25.69 14.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.149 -0.478 . . . . 62.439999999999998 110.922 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.495 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -67.44 -59.61 6.87 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.538 0.685 . . . . 75.329999999999998 111.058 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.553 ' O ' HG23 ' A' ' 10' ' ' ILE . 53.8 Cg_endo -69.78 -21.19 33.75 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.611 2.207 . . . . 64.409999999999997 112.388 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.3 tt -87.53 -17.29 32.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 72.140000000000001 110.941 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -88.74 15.06 8.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 74.439999999999998 111.1 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -144.08 14.84 1.69 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.135 -0.484 . . . . 54.43 110.889 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.553 HG23 ' O ' ' A' ' 6' ' ' PRO . 2.9 pp -117.08 -23.57 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.271 -0.422 . . . . 53.450000000000003 111.197 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.531 ' N ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -65.86 -17.16 21.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 72.329999999999998 111.117 179.861 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -118.37 -22.83 7.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 72.209999999999994 111.135 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -79.88 -0.95 36.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.209 -0.45 . . . . 61.439999999999998 110.9 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.591 ' HA ' HG22 ' A' ' 17' ' ' ILE . 2.8 pp -106.59 -12.42 10.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 73.319999999999993 111.102 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.83 -9.78 57.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 73.400000000000006 110.911 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -113.21 -44.46 3.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.172 -0.467 . . . . 75.329999999999998 110.881 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.591 HG22 ' HA ' ' A' ' 14' ' ' ILE . 11.2 tp -69.08 -30.15 45.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 74.430000000000007 111.14 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -142.1 12.82 2.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.145 -0.479 . . . . 62.43 111.132 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 C-N-CA 120.727 -0.749 . . . . 54.329999999999998 112.543 -179.956 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.709 0.29 . . . . 74.209999999999994 110.828 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 mtt -59.91 -18.26 43.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 74.430000000000007 110.899 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.551 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -101.82 0.27 35.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 74.200000000000003 110.912 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 11.2 mt -112.11 -22.04 11.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.137 -0.483 . . . . 62.439999999999998 110.926 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.489 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -72.75 -60.49 1.94 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.62 0.724 . . . . 75.329999999999998 111.185 179.877 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.734 ' HG2' HD12 ' A' ' 7' ' ' LEU . 53.4 Cg_endo -69.83 -20.48 34.47 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.641 2.227 . . . . 64.409999999999997 112.296 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.734 HD12 ' HG2' ' A' ' 6' ' ' PRO . 4.1 mp -109.24 6.5 24.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 72.140000000000001 110.93 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -47.25 -52.4 16.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.446 . . . . 74.439999999999998 111.16 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.677 ' H ' HD13 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -179.89 36.79 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 54.43 110.944 179.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.677 HD13 ' H ' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -125.54 19.08 4.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 53.450000000000003 111.154 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.507 HD13 ' H ' ' A' ' 11' ' ' ILE . 0.1 OUTLIER -135.86 6.29 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 72.329999999999998 111.131 179.835 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -178.67 32.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 72.209999999999994 111.098 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -122.26 -33.91 3.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 61.439999999999998 110.88 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.46 HD13 ' H ' ' A' ' 14' ' ' ILE . 0.1 OUTLIER -114.19 -20.39 6.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.251 -0.431 . . . . 73.319999999999993 111.104 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -89.5 -8.31 53.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.141 -0.482 . . . . 73.400000000000006 110.9 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -106.74 -41.09 5.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.142 -0.481 . . . . 75.329999999999998 110.873 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.2 tp -73.0 -30.92 33.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.169 -0.468 . . . . 74.430000000000007 111.11 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.67 -20.06 9.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.178 -0.465 . . . . 62.43 111.139 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 C-N-CA 120.768 -0.73 . . . . 54.329999999999998 112.481 -179.98 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.526 0.055 0 CA-C-O 120.728 0.299 . . . . 74.209999999999994 110.835 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.5 ttt -72.98 -8.27 54.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 74.430000000000007 110.916 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 30.6 tp -102.67 -19.86 14.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.227 -0.442 . . . . 74.200000000000003 110.858 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.528 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.2 mm? -93.79 -23.84 18.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 62.439999999999998 110.85 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.531 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -67.89 -57.93 8.83 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.63 0.729 . . . . 75.329999999999998 111.164 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.67 -25.49 28.97 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.722 2.281 . . . . 64.409999999999997 112.36 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.498 ' HG ' HG22 ' A' ' 10' ' ' ILE . 0.9 OUTLIER -88.17 -19.6 26.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 72.140000000000001 110.964 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.528 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -54.54 -26.43 31.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.466 . . . . 74.439999999999998 111.099 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -107.56 -30.23 8.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.435 . . . . 54.43 110.892 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.498 HG22 ' HG ' ' A' ' 7' ' ' LEU . 2.7 tp -54.93 -25.04 15.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 53.450000000000003 111.152 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.6 pt -64.97 -15.12 17.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.48 . . . . 72.329999999999998 111.071 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -119.41 -26.41 5.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 72.209999999999994 111.123 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 63.0 m170 -57.8 -23.92 54.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 61.439999999999998 110.91 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.506 ' HA ' HG22 ' A' ' 17' ' ' ILE . 2.9 pp -118.61 -12.82 10.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.192 -0.458 . . . . 73.319999999999993 111.049 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.6 ttt-85 -92.13 -17.45 24.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 73.400000000000006 110.839 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -104.74 -37.01 7.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.238 -0.437 . . . . 75.329999999999998 110.924 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.506 HG22 ' HA ' ' A' ' 14' ' ' ILE . 11.1 tp -70.46 -30.01 41.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.156 -0.475 . . . . 74.430000000000007 111.132 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -117.75 -16.35 10.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 62.43 111.077 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 C-N-CA 120.731 -0.747 . . . . 54.329999999999998 112.46 -179.962 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.769 0.318 . . . . 74.209999999999994 110.856 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -63.78 -15.86 59.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 74.430000000000007 110.903 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.559 ' O ' HD22 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -102.85 -4.29 25.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 74.200000000000003 110.907 -179.941 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 16.5 mt -106.6 -24.62 12.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 62.439999999999998 110.958 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.537 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -70.0 -57.79 5.9 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 121.548 0.69 . . . . 75.329999999999998 111.116 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.75 -19.9 35.57 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.717 2.278 . . . . 64.409999999999997 112.291 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.559 HD22 ' O ' ' A' ' 3' ' ' LEU . 11.0 mp -89.56 -19.95 24.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.258 -0.428 . . . . 72.140000000000001 110.933 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.64 16.55 11.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.449 . . . . 74.439999999999998 111.061 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.09 -32.35 3.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 54.43 110.945 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.9 pt -72.04 -35.15 52.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 53.450000000000003 111.135 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.7 pt -59.8 -19.19 16.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 72.329999999999998 111.158 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -117.36 -15.56 10.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.17 -0.468 . . . . 72.209999999999994 111.133 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -68.7 -24.55 64.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 61.439999999999998 110.78 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.508 ' HA ' HG22 ' A' ' 17' ' ' ILE . 2.9 pp -121.42 0.84 6.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.249 -0.432 . . . . 73.319999999999993 111.077 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -101.78 -19.79 15.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.184 -0.462 . . . . 73.400000000000006 110.798 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.6 -32.17 7.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 75.329999999999998 110.968 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.508 HG22 ' HA ' ' A' ' 14' ' ' ILE . 11.0 tp -72.18 -30.02 34.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.06 -0.518 . . . . 74.430000000000007 111.107 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -117.26 -18.46 9.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 62.43 111.132 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.281 0 C-N-CA 120.682 -0.771 . . . . 54.329999999999998 112.494 -179.987 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.2 mpp_? . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.868 0.366 . . . . 74.209999999999994 110.86 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.2 ptp -72.51 -8.64 56.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 74.430000000000007 110.917 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.9 -19.66 14.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.446 . . . . 74.200000000000003 110.94 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -92.62 -24.59 18.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 62.439999999999998 110.928 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.54 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -67.85 -57.79 9.13 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.535 0.683 . . . . 75.329999999999998 111.103 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.71 -23.44 31.03 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.669 2.246 . . . . 64.409999999999997 112.335 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.538 ' O ' HG23 ' A' ' 11' ' ' ILE . 0.7 OUTLIER -84.99 -20.6 30.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 72.140000000000001 110.933 -179.992 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -89.25 11.96 17.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 74.439999999999998 111.107 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.6 mmmt -136.94 9.34 3.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 54.43 110.928 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.538 HG23 ' O ' ' A' ' 6' ' ' PRO . 2.8 pp -117.51 -18.64 6.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 53.450000000000003 111.158 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.538 HG23 ' O ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -61.92 -16.15 15.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.149 -0.478 . . . . 72.329999999999998 111.104 179.82 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -124.43 -34.81 2.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.243 -0.435 . . . . 72.209999999999994 111.094 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.51 ' O ' HG23 ' A' ' 17' ' ' ILE . 84.5 t60 -50.35 -37.07 35.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 61.439999999999998 110.852 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.8 pt -67.01 -36.41 77.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 73.319999999999993 111.183 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.94 -19.16 48.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.475 . . . . 73.400000000000006 110.864 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -90.01 -33.4 16.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.202 -0.454 . . . . 75.329999999999998 110.881 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.51 HG23 ' O ' ' A' ' 13' ' ' HIS . 2.3 pp -86.25 -32.06 6.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 74.430000000000007 111.154 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -96.73 -23.31 16.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.464 . . . . 62.43 111.125 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.255 0 C-N-CA 120.668 -0.777 . . . . 54.329999999999998 112.474 179.972 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.878 0.371 . . . . 74.209999999999994 110.874 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.23 -15.92 50.12 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.201 -0.454 . . . . 74.430000000000007 110.941 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.38 -6.63 22.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 74.200000000000003 110.926 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.413 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 15.9 mt -103.16 -21.81 13.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 62.439999999999998 110.909 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.471 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -73.05 -60.97 1.64 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.64 0.733 . . . . 75.329999999999998 111.199 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.559 ' HA ' HD11 ' A' ' 10' ' ' ILE . 53.8 Cg_endo -69.81 -17.08 37.57 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.692 2.261 . . . . 64.409999999999997 112.336 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.512 HD23 HD11 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -112.43 5.61 18.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 72.140000000000001 110.94 179.964 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -47.03 -55.13 8.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 74.439999999999998 111.113 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.96 31.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.24 -0.436 . . . . 54.43 110.879 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.559 HD11 ' HA ' ' A' ' 6' ' ' PRO . 0.6 OUTLIER -114.04 11.46 8.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.249 -0.432 . . . . 53.450000000000003 111.1 179.889 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.52 HD13 ' H ' ' A' ' 11' ' ' ILE . 0.1 OUTLIER -133.95 4.8 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.474 . . . . 72.329999999999998 111.134 179.877 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -153.63 19.07 0.54 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.467 . . . . 72.209999999999994 111.117 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 -123.76 -36.4 2.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 61.439999999999998 110.868 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.5 pt -68.32 -36.41 74.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 73.319999999999993 111.149 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.35 -16.5 59.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.186 -0.461 . . . . 73.400000000000006 110.84 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -90.43 -35.62 15.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 75.329999999999998 110.899 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 25.5 pt -85.73 -31.74 6.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.121 -0.49 . . . . 74.430000000000007 111.087 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -97.09 -22.08 16.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.246 -0.434 . . . . 62.43 111.089 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.231 0 C-N-CA 120.757 -0.735 . . . . 54.329999999999998 112.457 -179.98 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.444 ' CG ' HD21 ' A' ' 4' ' ' LEU . 8.5 mtt180 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.815 0.34 . . . . 74.209999999999994 110.891 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.8 mtt -80.3 -1.32 40.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.218 -0.446 . . . . 74.430000000000007 110.874 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 39.7 tp -105.2 -26.72 11.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 74.200000000000003 110.928 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.531 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 pp -90.33 -22.92 21.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 62.439999999999998 110.921 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.529 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.01 -58.02 8.5 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.589 0.709 . . . . 75.329999999999998 111.145 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.7 Cg_endo -69.77 -25.53 28.47 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.643 2.228 . . . . 64.409999999999997 112.363 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.5 ' HG ' HG22 ' A' ' 10' ' ' ILE . 0.8 OUTLIER -87.56 -21.23 25.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 72.140000000000001 110.947 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -52.81 -28.29 21.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 74.439999999999998 111.106 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.25 -31.82 8.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 54.43 110.888 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.5 HG22 ' HG ' ' A' ' 7' ' ' LEU . 2.9 tp -52.55 -26.42 9.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 53.450000000000003 111.177 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.6 pt -65.96 -34.08 67.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 72.329999999999998 111.104 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -97.78 -14.84 20.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.227 -0.442 . . . . 72.209999999999994 111.07 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.568 ' O ' HG23 ' A' ' 17' ' ' ILE . 12.9 t-80 -75.67 -43.0 49.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 61.439999999999998 110.866 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.5 pt -66.3 -36.56 77.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 73.319999999999993 111.147 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.3 ptt85 -80.14 -14.26 58.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 73.400000000000006 110.909 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -97.76 -26.53 14.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.136 -0.484 . . . . 75.329999999999998 110.895 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.568 HG23 ' O ' ' A' ' 13' ' ' HIS . 2.5 pp -90.27 -33.44 5.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.112 -0.494 . . . . 74.430000000000007 111.126 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.466 ' HB2' HD12 ' A' ' 17' ' ' ILE . . . -121.3 19.46 11.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 62.43 111.111 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.268 0 C-N-CA 120.68 -0.772 . . . . 54.329999999999998 112.477 -179.929 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.133 0 CA-C-O 120.78 0.324 . . . . 74.209999999999994 110.925 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.7 ttp -64.8 -13.93 57.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 74.430000000000007 110.929 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 41.3 tp -100.6 -13.42 18.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 74.200000000000003 110.916 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.518 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.2 mm? -96.61 -25.09 15.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.152 -0.476 . . . . 62.439999999999998 110.873 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.492 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -66.99 -59.62 7.36 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 121.52 0.676 . . . . 75.329999999999998 111.178 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.5 Cg_endo -69.79 -22.53 31.79 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.72 2.28 . . . . 64.409999999999997 112.327 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.635 ' O ' HG23 ' A' ' 11' ' ' ILE . 0.7 OUTLIER -90.62 -17.04 27.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 72.140000000000001 110.923 179.986 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.518 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -59.49 -19.95 51.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 74.439999999999998 111.057 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.3 mptt -119.77 -27.1 5.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.248 -0.433 . . . . 54.43 110.856 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.7 tp -54.45 -27.23 17.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.281 -0.418 . . . . 53.450000000000003 111.119 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.635 HG23 ' O ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -62.64 -16.13 16.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 72.329999999999998 111.142 179.829 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -124.31 -16.93 6.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.167 -0.47 . . . . 72.209999999999994 111.161 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -54.24 -37.53 64.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.2 -0.454 . . . . 61.439999999999998 110.883 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.42 HD13 ' H ' ' A' ' 14' ' ' ILE . 0.1 OUTLIER -116.22 4.45 7.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 73.319999999999993 111.166 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.2 ttp85 -108.38 -11.99 15.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.468 . . . . 73.400000000000006 110.918 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -113.09 -33.7 5.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.47 . . . . 75.329999999999998 110.915 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.3 tp -73.49 -31.39 32.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 74.430000000000007 111.06 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.7 -21.24 9.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.161 -0.472 . . . . 62.43 111.165 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.375 0 C-N-CA 120.743 -0.742 . . . . 54.329999999999998 112.554 -179.963 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.492 ' HG3' HD22 ' A' ' 4' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.775 0.322 . . . . 74.209999999999994 110.872 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -11.04 60.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 74.430000000000007 110.867 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.48 -14.7 16.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 74.200000000000003 111.006 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.515 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 0.1 OUTLIER -96.43 -26.03 15.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 62.439999999999998 110.902 179.832 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.525 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -66.93 -57.79 10.71 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.572 0.701 . . . . 75.329999999999998 111.179 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.79 -24.37 29.6 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.719 2.28 . . . . 64.409999999999997 112.341 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.6 ' O ' HG23 ' A' ' 11' ' ' ILE . 3.8 tt -89.14 -17.96 28.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.21 -0.45 . . . . 72.140000000000001 110.89 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.515 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -59.61 -20.28 54.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 74.439999999999998 111.069 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -119.23 -26.69 5.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 54.43 110.948 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.4 HG22 ' HG ' ' A' ' 7' ' ' LEU . 2.7 tp -54.73 -26.14 16.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 53.450000000000003 111.105 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.6 HG23 ' O ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -63.78 -14.49 15.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 72.329999999999998 111.11 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -120.94 -26.81 5.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 72.209999999999994 111.074 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 50.7 t-80 -57.08 -23.83 49.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 61.439999999999998 110.811 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.478 HD12 ' C ' ' A' ' 14' ' ' ILE . 2.9 pp -117.44 -18.57 6.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.434 . . . . 73.319999999999993 111.145 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.476 ' N ' HD12 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -92.14 -1.97 56.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.463 . . . . 73.400000000000006 110.856 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -111.97 -41.16 4.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.245 -0.434 . . . . 75.329999999999998 110.838 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.5 pp -75.09 -30.63 23.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 74.430000000000007 111.127 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.85 -22.45 8.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 62.43 111.043 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.741 -0.742 . . . . 54.329999999999998 112.536 -179.938 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.445 ' HG2' HD21 ' A' ' 4' ' ' LEU . 6.3 mtm180 . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 120.776 0.322 . . . . 74.209999999999994 110.877 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.26 -1.35 40.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.473 . . . . 74.430000000000007 110.96 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.14 -26.67 11.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 74.200000000000003 110.96 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 pp -90.3 -22.9 21.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 62.439999999999998 110.94 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.526 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.02 -58.0 8.5 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.655 0.74 . . . . 75.329999999999998 111.146 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.74 -25.53 28.58 Favored 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.742 2.295 . . . . 64.409999999999997 112.353 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.5 tt -86.45 -19.09 30.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.231 -0.44 . . . . 72.140000000000001 110.947 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.521 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -62.56 -16.75 57.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.461 . . . . 74.439999999999998 111.066 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.4 pttt -114.37 -24.39 8.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.211 -0.45 . . . . 54.43 110.891 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.5 tp -58.37 -21.54 18.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.243 -0.435 . . . . 53.450000000000003 111.111 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -103.14 4.74 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.466 . . . . 72.329999999999998 111.12 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -136.15 14.68 3.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 72.209999999999994 111.087 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -121.61 -34.25 3.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.243 -0.435 . . . . 61.439999999999998 110.841 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.48 HD12 ' C ' ' A' ' 14' ' ' ILE . 2.9 pp -118.25 -14.24 9.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.236 -0.438 . . . . 73.319999999999993 111.044 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.1 ttt-85 -95.65 -12.06 26.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 73.400000000000006 110.91 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -105.85 -37.02 6.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 75.329999999999998 110.851 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.3 tp -75.31 -30.87 23.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.135 -0.484 . . . . 74.430000000000007 111.114 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.66 -22.81 8.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.242 -0.435 . . . . 62.43 111.093 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 C-N-CA 120.726 -0.75 . . . . 54.329999999999998 112.432 -179.872 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.775 0.321 . . . . 74.209999999999994 110.921 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.8 ttm -72.96 -8.33 55.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 74.430000000000007 110.882 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.74 -19.42 14.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 74.200000000000003 110.933 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.529 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 13.4 mt -94.77 -23.13 17.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.247 -0.433 . . . . 62.439999999999998 110.917 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.522 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.51 -57.88 7.89 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 121.599 0.714 . . . . 75.329999999999998 111.184 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.522 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.4 Cg_endo -69.85 -25.84 27.77 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.7 2.267 . . . . 64.409999999999997 112.307 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.2 tp -88.85 -18.48 27.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 72.140000000000001 110.946 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -51.32 -30.56 18.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.18 -0.464 . . . . 74.439999999999998 111.133 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -62.88 1.5 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 54.43 110.918 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.51 -26.14 9.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.269 -0.423 . . . . 53.450000000000003 111.12 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.43 HG22 ' O ' ' A' ' 8' ' ' ALA . 2.7 tp -52.53 -26.25 9.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 72.329999999999998 111.101 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -115.65 -29.14 6.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 72.209999999999994 111.156 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -51.98 -35.94 48.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 61.439999999999998 110.86 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.488 ' HA ' HG22 ' A' ' 17' ' ' ILE . 1.5 pt -71.22 -35.23 57.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 73.319999999999993 111.131 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.5 mmt180 -77.54 -9.15 58.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.092 -0.504 . . . . 73.400000000000006 110.908 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -106.06 -40.83 5.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 75.329999999999998 110.938 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.488 HG22 ' HA ' ' A' ' 14' ' ' ILE . 11.0 tp -71.86 -29.87 35.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 74.430000000000007 111.133 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.98 -17.7 10.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 62.43 111.141 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 C-N-CA 120.76 -0.733 . . . . 54.329999999999998 112.487 -179.97 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.815 0.341 . . . . 74.209999999999994 110.868 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -64.14 -14.79 57.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 74.430000000000007 110.879 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 mt -101.57 -9.72 20.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.194 -0.457 . . . . 74.200000000000003 110.923 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 21.6 mt -99.63 -25.43 14.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.175 -0.466 . . . . 62.439999999999998 110.917 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.505 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -68.33 -59.5 5.99 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.573 0.702 . . . . 75.329999999999998 111.162 179.96 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.505 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.7 -20.47 35.07 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.746 2.297 . . . . 64.409999999999997 112.356 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 28.1 tp -87.11 -21.06 26.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.223 -0.444 . . . . 72.140000000000001 110.977 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -90.88 43.75 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 74.439999999999998 111.089 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -168.62 -42.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 54.43 110.855 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.7 tp -55.01 -27.13 18.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.269 -0.423 . . . . 53.450000000000003 111.153 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.434 ' N ' HD13 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -64.97 -15.42 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 72.329999999999998 111.046 179.878 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -133.24 1.02 3.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 72.209999999999994 111.076 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.444 ' O ' HG22 ' A' ' 17' ' ' ILE . 1.6 t-80 -80.27 -31.07 38.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.44 . . . . 61.439999999999998 110.883 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.17 -18.83 17.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.242 -0.436 . . . . 73.319999999999993 111.14 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -95.41 -9.24 33.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 73.400000000000006 110.831 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -110.51 -32.93 6.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 75.329999999999998 110.838 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.444 HG22 ' O ' ' A' ' 13' ' ' HIS . 10.6 tp -79.55 -28.77 13.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 74.430000000000007 111.114 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.76 -25.56 7.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 62.43 111.161 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 C-N-CA 120.655 -0.783 . . . . 54.329999999999998 112.48 -179.993 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.7 ttt180 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.762 0.315 . . . . 74.209999999999994 110.876 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -72.6 -8.63 56.23 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.231 -0.44 . . . . 74.430000000000007 110.859 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 11.4 mt -102.75 -19.53 14.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.235 -0.439 . . . . 74.200000000000003 110.939 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -93.37 -24.27 18.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.197 -0.456 . . . . 62.439999999999998 110.902 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.531 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -67.83 -57.87 9.02 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.582 0.706 . . . . 75.329999999999998 111.116 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.73 -23.96 30.33 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.705 2.27 . . . . 64.409999999999997 112.368 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.63 ' HG ' HD13 ' A' ' 11' ' ' ILE . 1.0 OUTLIER -84.45 -24.55 29.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.454 . . . . 72.140000000000001 110.909 179.944 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.91 -18.31 60.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 74.439999999999998 111.117 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -92.6 -2.11 56.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 54.43 110.924 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.561 ' HA ' HD12 ' A' ' 14' ' ' ILE . 2.9 pp -128.0 -1.38 3.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 53.450000000000003 111.208 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.63 HD13 ' HG ' ' A' ' 7' ' ' LEU . 1.2 tp -79.78 -26.55 12.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.12 -0.491 . . . . 72.329999999999998 111.068 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -168.04 28.69 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 72.209999999999994 111.149 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -113.98 -9.64 12.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 61.439999999999998 110.847 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.561 HD12 ' HA ' ' A' ' 10' ' ' ILE . 0.0 OUTLIER -131.56 4.39 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.204 -0.453 . . . . 73.319999999999993 111.081 -179.971 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -106.37 -18.14 14.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.196 -0.456 . . . . 73.400000000000006 110.907 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -112.21 -29.13 7.68 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.235 -0.439 . . . . 75.329999999999998 110.844 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.5 HG22 ' HA ' ' A' ' 14' ' ' ILE . 10.8 tp -73.93 -29.77 26.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.129 -0.487 . . . . 74.430000000000007 111.151 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.97 -20.33 9.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 62.43 111.092 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 C-N-CA 120.733 -0.746 . . . . 54.329999999999998 112.461 -179.955 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.408 ' CG ' HD21 ' A' ' 4' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.75 0.31 . . . . 74.209999999999994 110.813 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -81.11 -0.7 41.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 74.430000000000007 110.83 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.5 mt -105.56 -26.88 11.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.445 . . . . 74.200000000000003 110.921 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.531 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 pp -90.61 -22.74 21.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 62.439999999999998 110.969 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.531 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -68.31 -58.0 8.04 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.58 0.705 . . . . 75.329999999999998 111.1 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.4 Cg_endo -69.74 -25.54 28.57 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.762 2.308 . . . . 64.409999999999997 112.347 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.67 -21.68 25.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 72.140000000000001 110.985 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -51.41 -30.54 19.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 74.439999999999998 111.092 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -76.23 -59.78 2.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 54.43 111.0 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.53 -26.16 9.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 53.450000000000003 111.196 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.403 HG22 ' O ' ' A' ' 8' ' ' ALA . 2.7 tp -52.5 -26.19 9.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 72.329999999999998 111.169 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -116.77 -27.38 6.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.154 -0.476 . . . . 72.209999999999994 111.091 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -54.03 -37.83 64.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 61.439999999999998 110.847 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.554 ' HA ' HG22 ' A' ' 17' ' ' ILE . 1.6 pt -72.63 -34.84 48.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.447 . . . . 73.319999999999993 111.186 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -76.56 -17.6 59.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.098 -0.501 . . . . 73.400000000000006 110.865 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -98.48 -37.24 9.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 75.329999999999998 110.911 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.554 HG22 ' HA ' ' A' ' 14' ' ' ILE . 10.9 tp -74.72 -29.61 23.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.146 -0.479 . . . . 74.430000000000007 111.148 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -109.47 -14.06 14.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.149 -0.478 . . . . 62.43 111.117 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 C-N-CA 120.766 -0.73 . . . . 54.329999999999998 112.467 -179.94 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.739 0.305 . . . . 74.209999999999994 110.858 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.2 ttm -66.88 -13.42 61.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.453 . . . . 74.430000000000007 110.869 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.41 -9.2 20.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.294 -0.412 . . . . 74.200000000000003 110.841 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -103.86 -23.57 13.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.212 -0.449 . . . . 62.439999999999998 110.942 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.538 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -69.16 -57.57 7.24 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.594 0.711 . . . . 75.329999999999998 111.123 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.8 Cg_endo -69.81 -24.64 29.22 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.703 2.269 . . . . 64.409999999999997 112.282 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.841 HD13 HD11 ' A' ' 10' ' ' ILE . 3.7 mm? -82.05 -29.41 31.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.249 -0.432 . . . . 72.140000000000001 110.959 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.13 58.73 1.61 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 74.439999999999998 111.115 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -178.7 -49.31 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.248 -0.433 . . . . 54.43 110.915 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.841 HD11 HD13 ' A' ' 7' ' ' LEU . 2.4 pt -64.43 -13.5 14.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 53.450000000000003 111.155 179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.412 HG23 ' O ' ' A' ' 7' ' ' LEU . 2.0 pt -58.33 -19.27 13.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 72.329999999999998 111.152 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -150.15 -37.49 0.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.449 . . . . 72.209999999999994 111.129 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 80.7 t60 -48.23 -36.93 14.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.239 -0.437 . . . . 61.439999999999998 110.858 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.482 HD12 ' C ' ' A' ' 14' ' ' ILE . 2.9 pp -116.94 -4.09 10.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 73.319999999999993 111.15 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.47 -7.3 26.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 73.400000000000006 110.895 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.85 -42.11 3.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 75.329999999999998 110.865 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 35.0 pt -69.43 -29.99 43.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.2 -0.455 . . . . 74.430000000000007 111.118 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -145.43 15.01 1.45 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.459 . . . . 62.43 111.116 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 C-N-CA 120.757 -0.735 . . . . 54.329999999999998 112.502 -179.989 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.782 0.325 . . . . 74.209999999999994 110.9 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 33.1 ttm -70.03 -10.74 59.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 74.430000000000007 110.846 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 48.9 mt -102.65 -15.49 16.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 74.200000000000003 110.914 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.89 -26.51 16.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.175 -0.466 . . . . 62.439999999999998 110.955 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.525 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -66.8 -57.66 11.23 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.548 0.69 . . . . 75.329999999999998 111.121 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.79 -22.95 31.24 Favored 'Trans proline' 0 N--CA 1.464 -0.232 0 C-N-CA 122.691 2.261 . . . . 64.409999999999997 112.386 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.6 tt -85.78 -21.55 28.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 72.140000000000001 110.915 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -83.52 3.98 29.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.233 -0.439 . . . . 74.439999999999998 111.088 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.56 -37.7 5.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 54.43 110.889 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.3 pt -67.65 -28.41 41.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 53.450000000000003 111.118 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.7 pt -87.47 43.14 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.208 -0.451 . . . . 72.329999999999998 111.134 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 179.61 -33.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 72.209999999999994 111.064 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.01 -11.62 60.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.259 -0.428 . . . . 61.439999999999998 110.837 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.516 HD12 ' C ' ' A' ' 14' ' ' ILE . 2.8 pp -108.05 -14.64 9.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 73.319999999999993 111.106 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.431 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.5 ppt_? -94.98 2.06 55.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.455 . . . . 73.400000000000006 110.828 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -120.91 -39.94 2.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 75.329999999999998 110.869 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.2 tp -71.93 -31.09 39.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 74.430000000000007 111.144 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -152.45 19.85 0.63 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.195 -0.457 . . . . 62.43 111.171 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.784 -0.722 . . . . 54.329999999999998 112.485 179.99 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.592 ' HG2' HD11 ' A' ' 4' ' ' LEU . 2.5 mtt180 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.872 0.368 . . . . 74.209999999999994 110.887 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.5 ptt? -85.73 -1.39 57.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.445 . . . . 74.430000000000007 110.884 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 84.6 mt -106.46 -20.29 13.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.243 -0.435 . . . . 74.200000000000003 110.888 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.592 HD11 ' HG2' ' A' ' 1' ' ' ARG . 3.5 pp -99.89 -21.04 15.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.235 -0.438 . . . . 62.439999999999998 110.943 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.541 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -70.05 -57.2 6.41 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.553 0.692 . . . . 75.329999999999998 111.155 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.9 Cg_endo -69.72 -26.79 27.41 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.681 2.254 . . . . 64.409999999999997 112.354 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.733 ' O ' HG23 ' A' ' 11' ' ' ILE . 3.9 mm? -80.68 -24.05 39.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 72.140000000000001 110.961 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -81.52 0.18 39.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.45 . . . . 74.439999999999998 111.052 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.22 2.08 13.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.291 -0.413 . . . . 54.43 110.907 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.465 HD12 ' C ' ' A' ' 10' ' ' ILE . 2.9 pp -121.43 -10.62 9.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 53.450000000000003 111.174 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.733 HG23 ' O ' ' A' ' 7' ' ' LEU . 2.7 pp -63.04 -15.65 16.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.142 -0.481 . . . . 72.329999999999998 111.159 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.693 ' N ' HD12 ' A' ' 11' ' ' ILE . . . -137.27 -41.89 0.57 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 72.209999999999994 111.088 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -60.04 -43.17 95.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 61.439999999999998 110.89 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.5 tp -68.66 -26.34 32.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 73.319999999999993 111.15 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -87.21 -10.65 52.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 73.400000000000006 110.872 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -104.16 -38.6 6.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.195 -0.457 . . . . 75.329999999999998 110.891 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 10.8 tp -76.45 -29.33 18.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 74.430000000000007 111.128 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.07 -21.4 10.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 62.43 111.1 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 C-N-CA 120.755 -0.736 . . . . 54.329999999999998 112.462 -179.983 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.615 ' HG2' HD22 ' A' ' 4' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.792 0.33 . . . . 74.209999999999994 110.855 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.2 mtt -60.78 -18.09 53.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 74.430000000000007 110.938 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.483 ' O ' HD23 ' A' ' 7' ' ' LEU . 6.4 mt -101.43 -0.73 34.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 74.200000000000003 110.856 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.615 HD22 ' HG2' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -109.93 -25.92 10.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.242 -0.436 . . . . 62.439999999999998 110.879 179.969 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.494 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -68.61 -59.58 5.59 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 121.592 0.711 . . . . 75.329999999999998 111.175 179.92 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.6 Cg_endo -69.74 -21.68 33.24 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.722 2.281 . . . . 64.409999999999997 112.366 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.483 HD23 ' O ' ' A' ' 3' ' ' LEU . 4.5 mm? -86.62 -21.58 26.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 72.140000000000001 110.896 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.99 58.02 1.44 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 74.439999999999998 111.094 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -166.15 -48.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 54.43 110.869 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -88.89 -1.4 8.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 53.450000000000003 111.107 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.545 HD12 ' C ' ' A' ' 11' ' ' ILE . 2.8 pp -91.39 14.35 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 72.329999999999998 111.141 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -154.05 -45.74 0.09 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 72.209999999999994 111.087 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 45.6 t60 -58.31 -36.21 73.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.219 -0.446 . . . . 61.439999999999998 110.917 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.5 tp -69.27 -26.19 31.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.446 . . . . 73.319999999999993 111.126 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -87.17 -10.49 52.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.466 . . . . 73.400000000000006 110.813 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.6 -39.02 6.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 75.329999999999998 110.903 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 10.9 tp -75.55 -29.48 20.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 74.430000000000007 111.082 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.5 -20.92 10.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 62.43 111.05 179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 C-N-CA 120.745 -0.741 . . . . 54.329999999999998 112.432 -179.877 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.094 0 CA-C-O 120.812 0.339 . . . . 74.209999999999994 110.841 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 mtm -67.83 -12.73 61.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.167 -0.47 . . . . 74.430000000000007 110.86 179.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.478 ' O ' HD13 ' A' ' 7' ' ' LEU . 7.2 mt -104.13 -6.69 20.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.28 -0.418 . . . . 74.200000000000003 110.901 -179.975 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.426 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 13.2 mt -108.17 -20.51 13.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 62.439999999999998 110.922 179.881 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.524 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -73.16 -58.33 2.52 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.544 0.688 . . . . 75.329999999999998 111.184 179.91 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.69 ' HG2' HD12 ' A' ' 7' ' ' LEU . 54.3 Cg_endo -69.73 -23.71 30.63 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.711 2.274 . . . . 64.409999999999997 112.387 179.873 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.69 HD12 ' HG2' ' A' ' 6' ' ' PRO . 3.8 mp -107.16 6.63 28.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 72.140000000000001 110.915 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.507 ' HB1' ' HD3' ' A' ' 9' ' ' LYS . . . -46.67 -53.24 12.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.471 . . . . 74.439999999999998 111.137 179.79 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.507 ' HD3' ' HB1' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -179.46 36.23 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.465 . . . . 54.43 110.917 179.997 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.483 HD11 ' HA ' ' A' ' 6' ' ' PRO . 0.5 OUTLIER -125.16 18.95 4.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 53.450000000000003 111.122 179.851 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.507 HD13 ' H ' ' A' ' 11' ' ' ILE . 0.1 OUTLIER -135.53 6.19 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.19 -0.459 . . . . 72.329999999999998 111.134 179.851 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -178.49 32.06 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.493 . . . . 72.209999999999994 111.16 179.796 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -122.73 -32.37 3.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.467 . . . . 61.439999999999998 110.856 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.527 ' HA ' HG22 ' A' ' 17' ' ' ILE . 2.9 pp -118.72 -12.54 10.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 73.319999999999993 111.152 -179.99 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.53 -18.99 21.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.487 . . . . 73.400000000000006 110.822 -179.975 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -103.5 -34.48 8.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.26 -0.427 . . . . 75.329999999999998 110.862 -179.964 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.527 HG22 ' HA ' ' A' ' 14' ' ' ILE . 10.9 tp -73.2 -29.78 29.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.455 . . . . 74.430000000000007 111.141 179.977 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.74 -18.9 10.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 62.43 111.077 179.807 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 C-N-CA 120.747 -0.74 . . . . 54.329999999999998 112.461 -179.911 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.825 0.345 . . . . 74.209999999999994 110.934 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 27.7 mtm -64.16 -15.68 60.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 74.430000000000007 110.873 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.432 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -102.07 -4.96 25.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.231 -0.44 . . . . 74.200000000000003 110.916 -179.977 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.513 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 mm? -108.22 -23.56 11.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 62.439999999999998 110.82 179.962 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.53 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -69.69 -57.93 6.15 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.672 0.749 . . . . 75.329999999999998 111.146 179.988 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.1 Cg_endo -69.73 -25.41 28.78 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.65 2.234 . . . . 64.409999999999997 112.379 179.913 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.432 HD23 ' O ' ' A' ' 3' ' ' LEU . 4.5 mm? -85.6 -21.73 28.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 72.140000000000001 110.881 -179.982 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.513 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -62.14 -20.72 64.39 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.169 -0.468 . . . . 74.439999999999998 111.08 179.825 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.0 -29.26 11.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 54.43 110.906 179.976 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.9 tp -52.22 -26.98 9.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.221 -0.445 . . . . 53.450000000000003 111.146 179.816 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.6 pt -67.02 -35.71 75.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 72.329999999999998 111.141 179.901 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.42 -46.09 20.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 72.209999999999994 111.101 179.812 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -55.78 -43.23 76.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 61.439999999999998 110.886 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.596 HD12 HD11 ' A' ' 17' ' ' ILE . 2.2 tp -57.79 -26.87 29.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 73.319999999999993 111.099 179.994 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -89.61 -10.12 47.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.447 . . . . 73.400000000000006 110.922 179.878 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -100.72 -30.32 11.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 75.329999999999998 110.861 -179.883 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.596 HD11 HD12 ' A' ' 14' ' ' ILE . 24.3 pt -89.29 -31.77 5.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.169 -0.469 . . . . 74.430000000000007 111.158 179.955 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.75 -21.95 19.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 62.43 111.116 179.798 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.293 0 C-N-CA 120.699 -0.763 . . . . 54.329999999999998 112.481 -179.928 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.469 ' HA ' HD21 ' A' ' 4' ' ' LEU . 10.7 ttt180 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.789 0.328 . . . . 74.209999999999994 110.869 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -84.17 4.64 29.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 74.430000000000007 110.931 179.968 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.77 -5.94 13.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.48 . . . . 74.200000000000003 110.933 -179.971 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.549 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.57 -23.94 10.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 62.439999999999998 110.951 179.897 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.496 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -68.34 -59.5 5.98 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.547 0.689 . . . . 75.329999999999998 111.174 179.896 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 5' ' ' THR . 54.2 Cg_endo -69.78 -25.91 28.02 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.695 2.263 . . . . 64.409999999999997 112.387 179.902 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.49 ' HG ' HG22 ' A' ' 10' ' ' ILE . 2.1 tt -87.13 -19.33 28.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 72.140000000000001 110.973 179.902 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.549 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -52.43 -28.4 19.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 74.439999999999998 111.118 179.742 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -106.6 -32.25 8.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 54.43 110.908 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.49 HG22 ' HG ' ' A' ' 7' ' ' LEU . 3.0 tp -52.06 -26.47 8.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 53.450000000000003 111.208 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.7 pt -65.37 -36.03 76.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.114 -0.494 . . . . 72.329999999999998 111.189 179.781 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -89.03 -28.3 20.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.189 -0.46 . . . . 72.209999999999994 111.078 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.07 -36.18 79.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.309 -0.405 . . . . 61.439999999999998 110.843 179.96 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.7 tp -65.08 -26.55 40.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 73.319999999999993 111.206 179.953 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -86.79 -9.92 54.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.088 -0.505 . . . . 73.400000000000006 110.893 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -103.54 -39.24 6.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.125 -0.489 . . . . 75.329999999999998 110.905 -179.917 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.4 tp -75.96 -31.05 21.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 74.430000000000007 111.138 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -112.66 -21.63 11.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.154 -0.475 . . . . 62.43 111.134 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.36 0 C-N-CA 120.73 -0.747 . . . . 54.329999999999998 112.476 -179.935 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.771 0.319 . . . . 74.209999999999994 110.862 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.4 ttm -77.37 -4.38 44.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.449 . . . . 74.430000000000007 110.853 179.946 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.804 HD12 HD13 ' A' ' 7' ' ' LEU . 41.5 tp -107.69 -11.72 15.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.439 . . . . 74.200000000000003 110.957 179.945 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.459 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.0 mm? -106.86 -20.14 13.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.204 -0.453 . . . . 62.439999999999998 110.899 179.905 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.538 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 1.1 m -73.17 -57.92 2.67 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.596 0.713 . . . . 75.329999999999998 111.14 179.943 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.688 ' HG2' HD12 ' A' ' 7' ' ' LEU . 53.8 Cg_endo -69.84 -23.88 29.95 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.634 2.222 . . . . 64.409999999999997 112.34 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.804 HD13 HD12 ' A' ' 3' ' ' LEU . 5.3 mp -106.51 5.87 29.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.454 . . . . 72.140000000000001 110.951 179.913 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.459 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -47.73 -51.92 20.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 74.439999999999998 111.053 179.804 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.632 ' H ' HD13 ' A' ' 10' ' ' ILE . 0.0 OUTLIER 179.7 33.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 54.43 110.869 179.993 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.632 HD13 ' H ' ' A' ' 9' ' ' LYS . 0.1 OUTLIER -128.45 27.73 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 53.450000000000003 111.159 179.859 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.711 HD12 ' HA ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -114.79 13.7 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.486 . . . . 72.329999999999998 111.135 179.899 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -178.86 -34.0 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.134 -0.485 . . . . 72.209999999999994 111.017 179.829 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 17.6 t60 -59.86 -19.09 49.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.267 -0.424 . . . . 61.439999999999998 110.774 -179.92 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.504 HD13 ' H ' ' A' ' 14' ' ' ILE . 0.1 OUTLIER -125.99 4.66 4.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 73.319999999999993 111.13 -179.935 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.58 -17.86 14.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.174 -0.466 . . . . 73.400000000000006 110.913 179.966 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -111.97 -29.48 7.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.473 . . . . 75.329999999999998 110.857 -179.894 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.481 HG22 ' HA ' ' A' ' 14' ' ' ILE . 10.8 tp -74.17 -29.67 25.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 74.430000000000007 111.171 179.967 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -117.02 -20.46 9.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.113 -0.494 . . . . 62.43 111.065 179.832 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 C-N-CA 120.713 -0.756 . . . . 54.329999999999998 112.484 -179.973 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.778 0.323 . . . . 74.209999999999994 110.831 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -59.76 -18.45 43.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.153 -0.476 . . . . 74.430000000000007 110.897 179.932 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.9 mt -102.24 0.92 35.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 74.200000000000003 110.913 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.415 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 4.1 mm? -112.25 -22.16 11.07 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.231 -0.44 . . . . 62.439999999999998 110.889 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.48 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -73.5 -60.86 1.55 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.575 0.702 . . . . 75.329999999999998 111.155 179.884 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 5' ' ' THR . 53.5 Cg_endo -69.72 -18.39 37.23 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.687 2.258 . . . . 64.409999999999997 112.375 179.905 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.451 HD23 HG21 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -112.57 7.98 19.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.267 -0.424 . . . . 72.140000000000001 110.962 179.911 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 4' ' ' LEU . . . -47.1 -67.03 0.32 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 74.439999999999998 111.032 179.805 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.0 35.74 0.21 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.263 -0.426 . . . . 54.43 110.878 179.956 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.776 HG22 HD13 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -122.62 2.83 5.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 53.450000000000003 111.153 179.82 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.451 HG21 HD23 ' A' ' 7' ' ' LEU . 1.5 pt -66.09 -36.5 77.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 72.329999999999998 111.121 179.849 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -137.83 -39.05 0.56 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 72.209999999999994 111.081 179.867 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -57.34 -33.52 67.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 61.439999999999998 110.825 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.776 HD13 HG22 ' A' ' 10' ' ' ILE . 2.3 tp -57.79 -26.81 28.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 73.319999999999993 111.162 179.989 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 -89.68 -10.23 46.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 73.400000000000006 110.879 179.949 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -100.66 -30.17 11.9 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.16 -0.473 . . . . 75.329999999999998 110.908 -179.958 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.586 HD11 HD12 ' A' ' 14' ' ' ILE . 24.5 pt -89.32 -31.68 5.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.172 -0.467 . . . . 74.430000000000007 111.126 179.951 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.12 -22.02 19.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.436 . . . . 62.43 111.102 179.766 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.235 0 C-N-CA 120.771 -0.728 . . . . 54.329999999999998 112.439 -179.951 . . . . . . . . 0 0 . 1 stop_ save_