data_2otr_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 2otr _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.795 0.331 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.53 -174.5 0.55 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.872 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -130.27 114.66 29.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.992 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.65 164.49 11.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.795 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 32.7 p -134.76 151.3 50.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.943 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.414 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 8.1 t -105.29 -169.52 1.61 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.07 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.0 mtmt -81.59 -56.44 4.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.887 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.2 mtmt -58.85 -30.76 67.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.825 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -63.62 -46.52 85.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.777 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -58.73 -30.8 67.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.963 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.13 -6.04 59.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.55 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.96 -49.67 6.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.817 0.341 . . . . 0.0 111.194 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.416 HD12 ' CE2' ' A' ' 22' ' ' PHE . 1.3 tp -59.43 -38.3 80.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.338 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.2 ptpp? -56.96 -26.46 59.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.316 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 29.1 mm -85.19 -28.56 6.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.375 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.1 mt -86.29 -32.47 21.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.138 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 p -64.49 -31.59 54.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.06 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.14 -40.2 38.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.932 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -77.64 -39.01 46.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.943 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 156.89 89.4 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.479 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.416 ' CE2' HD12 ' A' ' 14' ' ' LEU . 18.1 t80 -154.56 168.1 27.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.819 0.342 . . . . 0.0 110.876 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -122.01 155.31 35.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.946 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.4 mp -83.77 -50.86 7.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.982 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.2 ttmm -65.02 -21.05 66.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.123 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -52.85 -43.06 65.78 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.079 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.4 ' HA ' HG13 ' A' ' 30' ' ' VAL . 5.8 tp -64.23 -54.24 36.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.866 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -62.96 -18.27 62.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.953 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -90.07 -36.99 14.57 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.185 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.4 HG13 ' HA ' ' A' ' 27' ' ' LEU . 9.5 p -71.8 -20.99 20.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.451 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.5 p -49.35 -40.52 14.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.368 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.91 -28.62 66.29 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.354 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -89.98 -22.62 21.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.791 0.329 . . . . 0.0 111.096 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.5 mt -74.5 -35.86 63.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.854 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.05 -31.33 62.83 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.282 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 65.9 p -94.43 -34.7 12.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.937 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 60.1 62.17 1.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.739 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.55 -51.68 0.23 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.857 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -80.49 -80.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.337 2.025 . . . . 0.0 113.349 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.0 mm? 46.67 27.95 0.73 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.633 0.254 . . . . 0.0 111.432 -179.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.409 ' CB ' ' HB2' ' A' ' 44' ' ' TYR . . . 59.54 117.25 0.02 OUTLIER Pre-proline 0 CA--C 1.53 0.193 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.232 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -52.99 -41.92 68.09 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.461 2.107 . . . . 0.0 112.589 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.12 -26.76 60.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.32 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.409 ' HB2' ' CB ' ' A' ' 41' ' ' ALA . 3.5 m-85 -87.85 -66.42 0.92 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.839 0.352 . . . . 0.0 110.988 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.01 117.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.2 p-10 -56.1 157.25 4.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.061 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -162.01 155.18 17.42 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.949 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo . . . . . 0 C--N 1.345 0.353 0 C-N-CA 122.528 2.152 . . . . 0.0 112.286 179.995 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 56' ' ' PHE . 4.0 m-20 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.888 0.375 . . . . 0.0 110.908 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.424 ' CD2' ' O ' ' A' ' 55' ' ' ASP . 67.8 m-85 -157.05 122.88 4.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.851 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -143.41 139.89 30.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.719 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -121.51 143.09 49.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.987 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.8 p -131.28 -174.33 3.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.693 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 34.8 m-70 -143.14 90.49 2.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.987 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.1 pp -59.64 -41.28 90.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.721 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.61 166.05 12.94 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.832 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.0 -11.86 32.9 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.561 2.174 . . . . 0.0 112.594 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -145.57 48.18 1.26 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.8 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -156.68 132.19 9.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.168 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.03 177.81 5.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.247 179.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.414 HD21 ' CD1' ' A' ' 69' ' ' TYR . 5.7 tt -166.37 99.11 0.6 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.899 0.38 . . . . 0.0 111.403 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.4 t -90.0 136.41 23.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.115 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.414 ' CD1' HD21 ' A' ' 67' ' ' LEU . 7.3 p90 -153.03 169.69 22.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.925 0.393 . . . . 0.0 111.447 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -140.01 123.58 17.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.68 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 2.9 mm -84.82 150.28 4.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.329 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.48 87.06 2.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.76 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -21.14 43.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.213 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -50.85 -31.34 16.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.753 0.311 . . . . 0.0 111.021 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -144.0 17.48 1.76 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.201 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 47.99 71.91 0.31 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.809 0.337 . . . . 0.0 111.286 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 55.4 m -138.21 145.77 41.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.022 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.2 95.15 5.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.669 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.414 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.1 t80 -92.16 115.68 28.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.014 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.406 ' O ' ' CE1' ' A' ' 79' ' ' PHE . 20.0 mt -76.19 168.3 20.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.673 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 48.0 t -131.85 -68.94 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.086 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -128.16 167.06 17.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.951 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 9.7 tt -171.9 134.75 0.79 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.834 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.28 -149.51 21.44 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.581 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.8 150.08 48.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.818 0.342 . . . . 0.0 110.804 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -59.99 -43.36 95.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.824 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.7 p -70.82 -32.96 70.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.92 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.49 -56.59 6.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.861 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.0 mp . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.856 179.987 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.4 mt . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.851 0.357 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.13 -176.47 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.829 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -128.5 113.93 31.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.171 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -114.29 165.83 12.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.763 179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 63.0 p -132.57 162.42 31.33 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.023 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.411 ' HB3' ' CE1' ' A' ' 79' ' ' PHE . 1.0 OUTLIER -118.64 -176.53 3.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.918 -179.948 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.68 -47.36 32.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.856 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.9 mttt -67.52 -34.56 77.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.857 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -63.22 -31.22 72.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -69.29 -53.38 20.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.91 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -13.33 61.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.318 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -82.15 -29.2 31.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.774 0.321 . . . . 0.0 110.998 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.58 -31.71 63.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.983 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -26.48 68.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.058 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.1 mm -81.48 -29.74 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.21 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -84.51 -36.25 22.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.081 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.81 -33.75 63.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.133 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.7 tptt -71.23 -36.35 71.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -87.6 -24.25 24.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.961 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 138.3 94.69 0.32 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.354 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.427 ' CZ ' HD12 ' A' ' 26' ' ' LEU . 50.5 t80 -167.64 125.56 1.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.82 0.343 . . . . 0.0 110.988 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.95 -176.44 3.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.7 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -111.73 -32.14 6.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.95 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.57 -29.87 68.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.957 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.427 HD12 ' CZ ' ' A' ' 22' ' ' PHE . 4.2 pp -72.9 -31.33 64.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.992 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.67 -26.48 61.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.023 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -86.3 -29.31 23.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.897 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.19 -32.53 19.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.969 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.6 p -62.21 -18.56 20.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.267 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.6 p -50.97 -43.41 25.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.755 0.312 . . . . 0.0 111.26 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.19 -28.12 63.71 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.355 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.7 m-20 -89.96 -24.26 21.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.796 0.331 . . . . 0.0 111.006 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 68.4 mt -72.51 -34.01 67.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.942 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.96 -39.06 30.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.232 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.0 p -83.88 -38.99 20.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.886 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 59.71 66.69 0.96 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.925 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -94.56 -53.11 0.24 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.16 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -85.82 -88.97 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.611 2.207 . . . . 0.0 112.81 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 59.32 21.25 9.49 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.67 0.272 . . . . 0.0 111.038 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.31 128.73 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.002 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.17 -23.55 21.08 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.426 2.084 . . . . 0.0 112.476 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.35 -30.63 42.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.069 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.41 ' HB3' ' CD2' ' A' ' 60' ' ' HIS . 59.2 m-85 -101.56 -58.04 1.96 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.077 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.7 mttt 62.52 149.64 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.883 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -92.13 161.47 14.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.87 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -159.25 158.73 28.64 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.914 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo . . . . . 0 C--N 1.344 0.323 0 C-N-CA 122.654 2.236 . . . . 0.0 112.787 -179.929 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.801 0.334 . . . . 0.0 110.833 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -84.86 138.79 32.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.868 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -156.73 155.21 31.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.887 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -130.15 133.87 46.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.972 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 28.9 p -119.09 -172.04 2.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.798 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.41 ' CD2' ' HB3' ' A' ' 44' ' ' TYR . 68.7 m-70 -140.5 79.9 1.73 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.887 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.1 pp -55.91 -50.63 70.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.866 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.7 mttt -95.15 167.69 12.43 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.705 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.66 -12.78 37.25 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.545 2.163 . . . . 0.0 112.604 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -150.92 51.74 0.86 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.677 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -156.5 130.47 8.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.065 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.21 160.92 14.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.295 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.429 HD22 ' CD1' ' A' ' 69' ' ' TYR . 5.1 tt -148.78 102.62 3.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.854 0.359 . . . . 0.0 111.344 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.41 ' O ' ' N ' ' A' ' 81' ' ' VAL . 25.7 t -90.01 128.78 41.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.231 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.429 ' CD1' HD22 ' A' ' 67' ' ' LEU . 12.1 p90 -150.08 165.94 31.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.909 0.385 . . . . 0.0 111.13 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -145.95 124.38 12.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.858 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.438 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.5 mp -90.39 151.85 3.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.893 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.404 ' HB2' ' CG ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -120.62 104.0 9.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.733 179.758 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.76 -24.53 64.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.374 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.404 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 1.5 pt20 -53.22 -33.9 54.81 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.089 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -142.95 15.5 1.92 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.444 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 46.12 74.32 0.15 Allowed 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.78 0.324 . . . . 0.0 111.332 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.8 m -136.08 140.34 43.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.933 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.82 90.51 5.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.686 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.411 ' CE1' ' HB3' ' A' ' 7' ' ' SER . 2.9 t80 -90.0 106.94 18.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.916 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.4 mt -64.53 169.46 4.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.767 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.41 ' N ' ' O ' ' A' ' 68' ' ' VAL . 42.5 t -131.86 -69.81 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.174 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.8 mmm-85 -132.98 178.57 6.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.847 0.356 . . . . 0.0 111.101 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.7 tt -177.89 144.34 0.35 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.93 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 139.72 -131.72 5.28 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.576 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 39.3 t -147.98 147.12 29.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.769 0.319 . . . . 0.0 110.938 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -59.69 -30.95 69.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.838 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.2 m -78.87 -37.04 41.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.87 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -68.52 -55.43 11.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.854 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.3 mp . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.976 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.795 0.331 . . . . 0.0 110.838 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.73 -177.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.039 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.9 mp -131.64 130.43 62.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.055 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -121.57 165.94 14.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.803 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 43.1 p -127.43 160.14 32.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.026 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.42 ' HB3' ' CE1' ' A' ' 79' ' ' PHE . 0.5 OUTLIER -117.32 -176.37 2.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.912 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 ptpt -76.78 -47.14 22.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.857 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.7 mtpt -67.96 -31.18 70.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.775 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.408 ' CE1' HD23 ' A' ' 14' ' ' LEU . 56.2 t80 -59.65 -39.36 84.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.87 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.85 -34.51 78.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.939 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 mttm -78.54 -24.73 45.5 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.158 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -87.72 -28.58 21.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.109 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.408 HD23 ' CE1' ' A' ' 10' ' ' PHE . 0.1 OUTLIER -80.37 -28.41 38.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.14 -179.832 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 11.8 pttt -70.83 -28.53 64.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.267 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 28.4 mm -83.21 -45.17 18.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.312 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.4 mt -63.07 -40.35 97.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.012 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 p -64.27 -29.85 48.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.106 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -77.33 -37.51 52.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.903 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -82.24 -49.25 10.3 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.899 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 170.26 89.44 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.486 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -174.34 151.69 1.65 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.859 0.362 . . . . 0.0 110.856 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -126.7 159.2 34.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.908 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -89.46 -29.42 19.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.005 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -58.31 -41.49 84.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.896 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.9 pp -66.45 -31.34 72.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.861 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.3 tt -66.77 -28.37 68.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.041 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -78.84 -30.05 45.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.939 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -84.28 -35.58 23.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.065 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.6 p -69.63 -11.95 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.499 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.7 p -50.83 -41.57 21.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.858 0.361 . . . . 0.0 111.261 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.68 -28.37 72.23 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.297 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -84.66 -19.91 32.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.715 0.293 . . . . 0.0 111.21 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.3 mt -70.88 -45.38 64.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.798 0.332 . . . . 0.0 110.956 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.22 -50.17 66.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.242 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.8 p -75.26 -37.05 61.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.928 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 61.09 54.69 3.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.903 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.443 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 3.5 mt-30 -79.42 -52.59 1.13 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.31 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.443 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 56.0 Cg_endo -73.09 -88.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.065 1.843 . . . . 0.0 112.544 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.0 mp 51.95 -178.49 0.02 OUTLIER 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.758 0.313 . . . . 0.0 111.077 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.423 ' HB1' ' CD2' ' A' ' 44' ' ' TYR . . . -122.17 114.74 30.54 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.161 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.13 71.1 2.27 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.5 2.133 . . . . 0.0 112.299 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.75 -41.0 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.959 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.423 ' CD2' ' HB1' ' A' ' 41' ' ' ALA . 16.2 m-85 -85.54 5.47 31.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.42 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp 62.52 145.98 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.888 0.375 . . . . 0.0 110.978 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -156.04 109.3 2.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.874 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.42 ' CG ' ' HD2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -169.8 167.01 5.31 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.744 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 47' ' ' HIS . 43.1 Cg_endo . . . . . 0 C--N 1.345 0.358 0 C-N-CA 122.514 2.143 . . . . 0.0 112.306 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.701 0.286 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -69.28 133.09 47.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.009 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 21.4 mtp180 -150.75 150.83 31.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.743 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -139.17 120.87 15.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.883 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.1 p -127.82 150.78 49.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.875 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.412 ' CE1' ' HB3' ' A' ' 44' ' ' TYR . 10.8 m-70 -102.44 78.43 1.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.999 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.2 pp -58.99 -33.25 70.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.974 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.1 mmmm -127.61 159.66 64.78 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.713 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.54 122.71 12.12 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.649 2.232 . . . . 0.0 112.273 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 61.7 39.85 13.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.971 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -138.36 104.04 5.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.914 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -95.72 123.28 39.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.554 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.9 tt -117.82 99.51 6.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.945 0.402 . . . . 0.0 111.168 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.406 ' O ' ' N ' ' A' ' 81' ' ' VAL . 16.3 t -89.79 138.68 18.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.081 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -147.09 -178.07 6.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.086 0.469 . . . . 0.0 111.57 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -162.1 111.45 1.49 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.574 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.422 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.5 mp -84.7 146.62 6.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.058 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.06 103.95 11.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.742 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.08 -22.21 26.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.328 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -47.49 -36.65 10.54 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.289 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -148.26 21.03 1.08 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.268 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 26.4 m-20 48.27 71.92 0.31 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.914 0.387 . . . . 0.0 111.117 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 99.7 m -128.71 147.54 50.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.911 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -102.5 92.63 4.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.727 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.42 ' CE1' ' HB3' ' A' ' 7' ' ' SER . 2.1 t80 -91.19 102.7 15.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.872 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.65 167.21 6.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.716 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.406 ' N ' ' O ' ' A' ' 68' ' ' VAL . 59.3 t -137.92 -66.62 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.971 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.39 163.34 15.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.974 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -176.38 91.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.826 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 172.53 -152.29 16.31 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.667 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.3 t -127.0 141.71 51.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.856 0.36 . . . . 0.0 110.805 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -59.39 -30.16 68.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.891 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.15 -31.47 30.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.906 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -69.12 -48.86 61.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.923 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.6 mp . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.882 -179.949 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.6 mp . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.769 0.318 . . . . 0.0 110.823 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.45 -177.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.836 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.9 mp -128.76 123.01 58.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.039 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -121.05 166.02 14.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.79 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 41.3 p -134.4 150.72 50.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.985 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.426 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 2.6 t -105.49 178.32 4.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.005 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.21 -47.11 65.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.807 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -68.46 -31.94 71.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.742 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.419 ' CZ ' HD11 ' A' ' 80' ' ' LEU . 85.2 t80 -64.02 -41.84 97.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.892 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -60.3 -52.71 64.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.935 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.2 ptmt -69.71 -12.41 61.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.26 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -90.05 -24.22 21.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.247 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.2 tp -89.97 -44.68 9.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.384 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.51 -24.64 13.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.413 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 29.4 mm -80.67 -28.88 11.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.223 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 25.3 mt -87.06 -38.4 16.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.071 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.1 p -59.05 -40.32 80.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.04 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -30.0 69.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.836 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -100.64 28.26 5.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.888 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.68 102.79 0.55 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.673 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.419 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 53.5 t80 -175.67 -40.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.713 0.292 . . . . 0.0 110.878 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 59.41 173.9 0.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.912 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -117.86 17.05 14.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.081 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.02 -33.54 16.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.875 0.369 . . . . 0.0 110.871 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.419 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 4.3 pp -64.66 -29.62 70.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.977 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.411 ' HA ' ' CG1' ' A' ' 30' ' ' VAL . 3.3 tp -71.75 -36.36 70.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.903 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -76.47 -27.65 56.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.874 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.84 -31.57 20.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.986 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.411 ' CG1' ' HA ' ' A' ' 27' ' ' LEU . 14.7 p -78.36 -5.0 7.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.614 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.0 m -53.03 -42.91 46.41 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-O 120.89 0.376 . . . . 0.0 111.361 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.85 -26.98 70.52 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.432 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.2 m-20 -85.61 -22.4 28.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.632 0.253 . . . . 0.0 111.129 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 75.2 mt -76.54 -48.64 18.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.902 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.09 -36.02 82.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.213 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.5 p -88.16 -42.69 12.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.985 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 61.88 57.29 2.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.876 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.406 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 0.2 OUTLIER -88.72 -51.89 0.38 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.412 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.406 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 74.2 Cg_endo -79.95 -92.93 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.221 1.947 . . . . 0.0 112.703 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 55.86 -178.24 0.04 OUTLIER 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.826 0.346 . . . . 0.0 111.074 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.424 ' HB1' ' CD2' ' A' ' 44' ' ' TYR . . . -128.32 106.46 19.47 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.04 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.97 -7.14 20.76 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.425 2.083 . . . . 0.0 112.793 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.2 32.0 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.697 0.284 . . . . 0.0 111.013 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.424 ' CD2' ' HB1' ' A' ' 41' ' ' ALA . 18.1 m-85 -139.95 -79.66 0.3 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.932 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -177.98 37.67 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.922 0.391 . . . . 0.0 110.893 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.405 ' O ' ' CG ' ' A' ' 47' ' ' HIS . 43.3 p-10 -71.99 75.14 0.92 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.876 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.405 ' CG ' ' O ' ' A' ' 46' ' ' ASP . 1.4 m-70 -178.16 170.0 0.89 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.905 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo . . . . . 0 C--N 1.346 0.425 0 C-N-CA 122.599 2.199 . . . . 0.0 112.231 179.98 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.864 0.364 . . . . 0.0 110.72 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -80.61 129.32 34.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.855 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -148.22 133.31 18.26 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.728 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -109.76 146.37 35.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.97 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 21.2 m -149.69 141.95 24.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.772 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.405 ' CE1' HD23 ' A' ' 66' ' ' LEU . 10.0 m-70 -101.97 92.72 4.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.008 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.0 pp -62.2 -39.88 94.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.755 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -104.53 169.14 7.54 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.741 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -71.1 -7.91 22.41 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.559 2.172 . . . . 0.0 112.95 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -150.6 45.01 0.86 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.864 0.364 . . . . 0.0 111.156 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.3 mp -158.91 130.21 6.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.152 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.405 HD23 ' CE1' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -94.24 -179.41 4.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.28 179.532 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.4 tt -170.09 102.24 0.29 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.836 0.35 . . . . 0.0 111.383 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.415 ' O ' ' N ' ' A' ' 81' ' ' VAL . 22.8 t -95.23 137.33 23.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.444 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -147.05 170.55 16.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.982 0.42 . . . . 0.0 111.405 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -143.03 114.2 7.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.553 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.441 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.4 mp -84.89 135.52 24.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.933 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.98 103.79 12.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.85 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.77 -19.85 62.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.153 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -51.65 -36.51 46.45 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.861 0.362 . . . . 0.0 111.042 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -144.99 18.56 1.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.193 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.8 m120 47.27 77.24 0.09 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.829 0.347 . . . . 0.0 111.188 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 63.7 m -137.39 144.04 42.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.102 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 38.1 tp -98.61 91.09 4.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.451 179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.426 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.1 t80 -89.8 105.82 18.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.888 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.419 HD11 ' CZ ' ' A' ' 10' ' ' PHE . 3.0 mt -64.75 169.26 5.22 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.774 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.415 ' N ' ' O ' ' A' ' 68' ' ' VAL . 74.7 t -136.8 -71.48 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.086 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -118.67 168.44 10.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.932 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.5 tt -176.61 117.37 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.923 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 158.14 -147.86 16.32 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.497 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.8 136.89 29.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.821 0.343 . . . . 0.0 110.917 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.38 -30.4 66.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.909 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.7 p -76.75 -30.77 56.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.859 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -80.27 -54.84 5.36 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.927 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.5 mp . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.772 179.918 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.5 mp . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.759 0.314 . . . . 0.0 110.926 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.76 -173.41 0.46 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.792 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.0 mp -130.2 136.76 57.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.075 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -139.63 161.09 38.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.753 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.6 p -135.36 155.43 50.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.082 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.41 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 8.7 p -110.89 -168.7 1.34 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.795 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -81.14 -42.47 20.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.942 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 71.0 mttt -72.25 -41.05 67.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.892 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.407 ' CE1' HD22 ' A' ' 14' ' ' LEU . 14.2 t80 -59.86 -34.39 73.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.805 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -65.61 -31.12 71.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.6 mtpp -87.36 -8.04 57.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.389 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -88.98 -29.48 19.48 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.792 0.329 . . . . 0.0 111.128 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.407 HD22 ' CE1' ' A' ' 10' ' ' PHE . 21.9 mt -84.08 -35.3 23.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.076 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 27.7 pttt -58.7 -29.85 66.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.172 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.426 HG22 HD12 ' A' ' 16' ' ' ILE . 29.3 mm -79.89 -39.16 19.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.282 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.6 mp -72.31 -41.04 67.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.014 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.6 p -63.74 -30.14 49.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.232 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -76.55 -33.9 58.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.824 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -83.15 -59.27 2.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.765 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -170.07 63.11 0.17 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.378 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.421 ' CZ ' HD13 ' A' ' 26' ' ' LEU . 1.3 t80 -151.21 172.09 16.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.81 0.338 . . . . 0.0 110.89 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -151.42 144.1 24.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.826 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.0 mp -71.25 -23.78 62.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.043 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -51.73 68.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.073 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.421 HD13 ' CZ ' ' A' ' 22' ' ' PHE . 2.4 pp -58.75 -31.75 68.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.007 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.24 -31.24 72.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.894 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -80.72 -26.65 37.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.7 mtpp -87.57 -29.41 21.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.973 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.8 p -76.12 -16.88 15.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.471 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.8 t -48.39 -42.06 11.6 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 120.83 0.348 . . . . 0.0 111.356 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.83 -27.5 64.39 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.339 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.9 m-20 -85.32 -22.44 28.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.819 0.343 . . . . 0.0 111.039 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.6 mt -74.26 -33.4 63.28 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.85 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.88 -43.27 62.72 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.087 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 73.3 p -86.26 -39.29 16.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.87 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 60.85 67.96 0.78 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.846 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.406 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -92.93 -53.57 0.26 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.255 -179.74 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.406 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 57.6 Cg_endo -82.82 -86.58 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 122.287 1.991 . . . . 0.0 112.545 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.8 mp 55.38 39.44 31.2 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.786 0.327 . . . . 0.0 111.148 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 60.54 100.31 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.206 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.35 62.24 2.73 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.465 2.11 . . . . 0.0 112.404 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.12 -44.6 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.967 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -82.33 -29.68 30.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.9 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.3 mmpp? 62.08 118.7 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.032 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -81.94 154.73 25.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.716 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 12.3 p80 177.09 156.72 0.46 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.869 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo . . . . . 0 C--N 1.343 0.266 0 C-N-CA 122.621 2.214 . . . . 0.0 112.419 179.974 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.861 0.362 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -80.72 174.42 11.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.827 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -175.53 125.73 0.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.837 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -116.03 130.56 56.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.782 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 28.5 p -134.3 -175.68 3.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.971 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 85.8 m-70 -134.67 80.37 1.85 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.014 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.3 pp -57.34 -31.24 65.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.122 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -135.6 151.63 74.78 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.984 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -51.81 133.31 44.84 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.522 2.148 . . . . 0.0 112.34 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 59.41 25.55 14.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.011 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.3 mp -134.35 117.28 16.19 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.787 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.03 179.35 5.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.717 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 37.8 tp -167.39 100.35 0.51 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.372 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' A' ' 81' ' ' VAL . 41.4 t -95.3 123.33 47.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.893 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 10.3 p90 -138.78 159.5 41.97 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.976 0.417 . . . . 0.0 111.463 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -136.96 118.28 14.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.519 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.425 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.4 mp -84.94 123.63 39.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.921 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.03 100.52 12.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.699 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.89 -22.62 38.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.112 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -49.57 -36.06 22.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.844 0.354 . . . . 0.0 111.049 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -145.39 18.29 1.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.257 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 47.23 71.01 0.35 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.804 0.335 . . . . 0.0 111.217 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 97.6 m -130.19 148.68 52.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.065 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 65.0 tp -102.13 90.5 3.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.541 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.412 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 3.5 t80 -89.93 115.77 27.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.017 -179.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.412 ' O ' ' CE1' ' A' ' 79' ' ' PHE . 3.3 mm? -68.97 168.14 14.35 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.706 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.425 ' N ' ' O ' ' A' ' 68' ' ' VAL . 43.9 t -141.0 -58.75 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.98 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 41.5 mmm-85 -131.54 165.49 23.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.842 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.9 tt -177.05 139.1 0.26 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.948 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 118.85 -143.35 17.39 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.59 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.9 t -127.4 147.74 50.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.806 0.336 . . . . 0.0 110.861 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -59.3 -30.78 68.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.915 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.3 m -87.22 -31.52 20.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -67.7 -31.4 71.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.9 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.746 0.308 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.81 -170.45 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.863 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.0 mp -130.97 136.22 58.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.89 0.376 . . . . 0.0 111.187 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -128.31 170.05 13.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.644 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.6 p -137.68 165.66 25.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.854 0.359 . . . . 0.0 111.075 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.3 -175.3 3.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.913 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.13 -53.08 13.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.964 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -62.41 -36.29 81.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.913 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -59.56 -33.17 71.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.93 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -70.57 -40.6 73.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.849 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.1 mttt -78.31 -4.94 50.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.337 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -90.08 -56.54 3.18 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.829 0.347 . . . . 0.0 111.173 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -54.67 -36.8 65.0 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.224 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.8 ptpt -58.9 -30.29 67.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.998 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.1 mm -82.58 -30.48 9.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.249 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 69.5 mt -81.78 -39.5 24.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.949 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.7 p -59.74 -33.47 52.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.08 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.1 tttp -78.88 -30.06 44.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.991 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -98.33 29.07 3.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.93 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.09 95.42 0.89 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.603 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -176.66 101.52 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.837 0.351 . . . . 0.0 110.956 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -60.2 -167.87 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.863 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -118.7 -39.92 2.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.997 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.3 mttp -66.67 -27.06 67.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.181 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.4 ' CD1' ' N ' ' A' ' 27' ' ' LEU . 3.9 pp -57.92 -41.85 83.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.045 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.4 ' N ' ' CD1' ' A' ' 26' ' ' LEU . 2.8 tp -64.46 -30.05 71.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.038 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -73.37 -27.63 61.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.144 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.86 -30.63 18.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.054 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 34.8 t -75.01 -18.06 16.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.384 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 28.1 m -49.47 -27.97 3.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.828 0.347 . . . . 0.0 111.441 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -72.34 -27.39 69.92 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.606 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -86.97 -28.53 22.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.759 0.314 . . . . 0.0 111.077 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.3 mt -65.11 -44.61 88.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.981 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.84 -35.96 67.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.32 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 78.0 p -77.24 -45.12 27.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.887 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 60.81 55.97 3.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.794 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.409 ' N ' ' CD ' ' A' ' 39' ' ' PRO . 0.1 OUTLIER -91.72 -52.22 0.29 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.097 -179.799 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.409 ' CD ' ' N ' ' A' ' 38' ' ' GLN . 47.2 Cg_endo -83.48 -78.31 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.422 2.081 . . . . 0.0 112.736 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 57.7 24.75 10.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.728 0.299 . . . . 0.0 111.01 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.24 138.52 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.096 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.71 -20.88 15.1 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.583 2.189 . . . . 0.0 112.538 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.42 ' HG2' ' CD2' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -97.67 31.58 2.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.11 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.42 ' CD2' ' HG2' ' A' ' 43' ' ' LYS . 72.5 m-85 -157.92 -70.88 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.066 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 5.9 mmmt 63.55 139.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.933 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -73.58 161.94 29.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.939 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -165.08 154.26 11.23 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.867 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo . . . . . 0 C--N 1.344 0.29 0 C-N-CA 122.57 2.18 . . . . 0.0 112.324 179.962 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.802 0.334 . . . . 0.0 110.842 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -87.68 147.92 25.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.765 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -160.79 147.0 14.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.95 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.0 tt0 -127.48 117.63 22.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.933 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 30.3 p -115.02 177.48 4.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.843 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -124.05 90.05 3.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.893 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.8 pp -65.82 -32.43 73.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.883 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.4 mttp -139.16 165.18 33.89 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.809 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -62.01 130.58 31.38 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.54 2.16 . . . . 0.0 112.153 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 61.14 31.03 19.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.839 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -140.14 118.16 11.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.812 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -97.6 177.64 5.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.616 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.9 tt -165.37 102.35 0.73 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.12 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.409 ' O ' ' N ' ' A' ' 81' ' ' VAL . 37.5 t -94.65 124.16 47.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.167 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 5.6 p90 -141.18 157.94 44.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.933 0.397 . . . . 0.0 111.244 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -137.26 114.04 10.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.75 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.449 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.3 mp -84.98 131.99 32.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.88 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.417 ' HB2' ' CG ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -106.55 102.42 11.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.801 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.1 mttp -59.33 -23.43 62.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.491 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.417 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 1.1 pt20 -51.26 -33.49 28.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.73 0.3 . . . . 0.0 111.141 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -145.51 17.2 1.49 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.482 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 m120 46.53 72.61 0.22 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.894 0.378 . . . . 0.0 111.256 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.1 m -131.18 142.93 50.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.921 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 64.4 tp -97.06 90.29 5.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.525 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -91.68 106.35 18.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.899 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.43 -177.57 0.43 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.675 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.409 ' N ' ' O ' ' A' ' 68' ' ' VAL . 45.6 t -153.25 -62.99 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.165 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -127.54 166.49 17.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.868 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 tt -178.26 132.6 0.14 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.856 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 129.76 -145.82 16.8 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.495 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.6 t -129.41 148.23 51.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.845 0.355 . . . . 0.0 110.871 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -64.34 -39.08 93.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 45.2 p -66.43 -31.23 71.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.865 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.68 -53.04 24.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.893 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 mp . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 179.907 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.881 0.372 . . . . 0.0 110.899 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.73 -178.88 0.33 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.855 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.2 mp -131.46 114.58 26.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.116 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -106.57 168.37 9.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.733 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 76.6 p -137.28 148.96 46.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.067 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.417 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 28.9 t -103.55 -167.94 1.44 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.833 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -84.79 -47.75 10.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.803 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -70.51 -28.08 64.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.976 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.421 ' CE1' HD23 ' A' ' 14' ' ' LEU . 17.6 t80 -56.98 -30.87 64.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.99 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -75.44 -46.81 30.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.926 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.1 mtpp -66.86 -21.91 66.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.173 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.22 -28.67 23.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.817 0.341 . . . . 0.0 111.099 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.421 HD23 ' CE1' ' A' ' 10' ' ' PHE . 0.2 OUTLIER -79.28 -34.9 42.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.037 -179.883 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -56.81 -24.53 51.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.228 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.1 mm -80.36 -45.88 21.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.413 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.8 mp -72.65 -44.47 61.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.125 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.3 p -56.4 -30.04 29.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.224 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.15 -40.19 22.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.997 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -70.59 -62.61 1.32 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.946 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -178.86 75.35 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.51 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.421 ' CD2' HD12 ' A' ' 14' ' ' LEU . 86.0 t80 -153.03 137.51 16.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.805 0.336 . . . . 0.0 110.869 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.24 119.49 39.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.79 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.46 -23.67 26.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.182 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.5 tttm -59.2 -50.24 74.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.027 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.0 pp -57.86 -28.54 64.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.096 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.5 tt -64.88 -26.68 68.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.998 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -80.38 -28.09 38.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.172 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -87.53 -29.35 21.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.195 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.0 p -75.31 -25.73 18.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.328 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.5 p -47.23 -32.86 2.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.496 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.36 -26.44 74.56 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.454 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -88.5 -23.78 23.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.759 0.314 . . . . 0.0 111.139 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 34.1 mt -69.34 -38.12 78.0 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.922 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.64 -12.16 59.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.623 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.1 p -107.68 -44.55 4.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.839 0.352 . . . . 0.0 110.99 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 60.8 60.78 1.81 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.697 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.402 ' N ' ' CD ' ' A' ' 39' ' ' PRO . 1.1 mt-30 -91.64 -52.05 0.29 Allowed Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.519 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.402 ' CD ' ' N ' ' A' ' 38' ' ' GLN . 65.4 Cg_endo -80.29 -90.64 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 122.348 2.032 . . . . 0.0 112.988 -179.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 62.41 -167.54 0.2 Allowed 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.761 0.315 . . . . 0.0 110.716 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -112.38 137.41 21.57 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.997 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -73.58 -29.11 11.22 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.526 2.151 . . . . 0.0 112.37 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.71 -29.77 45.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.025 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -97.39 -53.3 3.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.995 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.52 149.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.833 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -97.28 147.31 24.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.86 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -172.82 159.71 3.72 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.953 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo . . . . . 0 C--N 1.344 0.33 0 C-N-CA 122.646 2.231 . . . . 0.0 112.377 -179.996 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.853 0.358 . . . . 0.0 110.719 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -60.27 147.82 38.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.752 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.9 mtt85 -159.28 125.14 4.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.916 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -112.6 108.15 17.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.889 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.5 p -105.36 172.45 6.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.985 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 13.3 m-70 -124.52 83.2 2.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.84 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.2 pp -55.73 -40.78 72.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.032 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.1 mmtm -117.54 155.87 49.91 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -48.23 -25.85 7.47 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.733 2.289 . . . . 0.0 112.627 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -141.04 75.36 1.5 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.816 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -174.54 119.6 0.23 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.079 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -89.89 151.87 21.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.357 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.1 tt -145.3 97.58 3.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.919 0.39 . . . . 0.0 111.394 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.413 ' O ' ' N ' ' A' ' 81' ' ' VAL . 37.7 t -92.47 122.0 43.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.785 178.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.451 ' CD1' ' CD1' ' A' ' 71' ' ' ILE . 5.8 p90 -140.38 162.92 34.15 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.996 0.427 . . . . 0.0 111.412 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -144.26 108.08 4.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.575 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.451 ' CD1' ' CD1' ' A' ' 69' ' ' TYR . 1.5 mp -84.88 133.65 28.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.927 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.35 100.67 10.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.716 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -58.68 -21.77 55.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.343 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -55.0 -29.89 58.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.79 0.329 . . . . 0.0 111.161 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -144.37 16.12 1.67 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.392 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 46.94 72.1 0.27 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.865 0.364 . . . . 0.0 111.251 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 99.0 m -134.83 142.51 46.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.946 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.4 tt -99.64 93.11 5.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.726 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 3.6 t80 -92.2 107.62 19.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.877 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.418 HD12 ' CE2' ' A' ' 10' ' ' PHE . 2.1 mt -67.13 -179.85 1.04 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.563 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.413 ' N ' ' O ' ' A' ' 68' ' ' VAL . 43.9 t -154.25 -56.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.144 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.81 163.77 16.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.112 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -177.39 101.08 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.849 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -178.21 169.43 41.17 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.523 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.3 p -95.48 148.81 22.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.8 0.333 . . . . 0.0 110.841 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -68.63 -30.99 69.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.881 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.1 t -70.07 -39.65 75.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.95 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -76.73 -59.04 2.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.882 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.4 mp . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.911 -179.955 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.86 0.362 . . . . 0.0 110.908 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.99 -171.14 1.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.013 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.6 mp -137.06 135.89 47.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.042 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -133.58 162.71 31.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.83 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 41.0 p -138.09 147.82 44.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.988 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -105.44 171.85 7.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.997 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -43.91 87.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.974 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -65.05 -42.65 94.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.885 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.413 ' CZ ' HD11 ' A' ' 14' ' ' LEU . 13.3 t80 -59.22 -37.49 77.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.848 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -58.57 -30.49 67.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.825 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.8 mttp -82.11 -23.83 35.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.997 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.22 -23.81 43.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.159 -179.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.414 HD13 ' CE2' ' A' ' 22' ' ' PHE . 2.1 tp -89.96 -39.38 13.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.247 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.3 -30.43 62.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.125 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.9 mm -82.19 -29.26 9.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.128 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.1 mt -79.37 -36.94 38.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.015 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.3 p -65.26 -33.99 67.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.058 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -74.13 -31.3 62.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.963 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -87.67 -56.18 3.46 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.904 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -176.83 78.45 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.545 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.414 ' CE2' HD13 ' A' ' 14' ' ' LEU . 7.5 t80 -158.25 166.77 31.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.795 0.331 . . . . 0.0 110.819 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -130.99 170.95 13.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.928 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.66 -52.37 3.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.916 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.95 -28.91 68.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.974 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.46 -32.52 68.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.893 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 10.0 tt -77.49 -35.45 53.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.101 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -76.52 -23.43 53.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.969 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -88.73 -37.45 15.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.879 0.371 . . . . 0.0 111.002 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.1 p -66.08 -15.39 18.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.469 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 22.5 m -49.25 -39.29 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.13 0 CA-C-O 120.73 0.3 . . . . 0.0 111.325 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.57 -27.3 63.48 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.485 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -89.81 -31.52 17.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.881 0.372 . . . . 0.0 110.91 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 65.3 mt -62.3 -46.75 87.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.848 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.88 -33.57 74.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.116 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 76.2 p -81.75 -42.27 20.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.987 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 61.62 45.41 8.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.003 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.426 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 2.4 mt-30 -80.83 -52.3 0.89 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.17 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.426 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 50.4 Cg_endo -73.96 -85.5 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.13 1.887 . . . . 0.0 112.659 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mt 59.88 22.87 11.88 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.762 0.315 . . . . 0.0 111.233 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 61.71 119.28 0.02 OUTLIER Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.071 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -75.07 59.49 5.25 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.449 2.099 . . . . 0.0 112.428 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.438 ' HG3' ' CE2' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -153.13 -45.22 0.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.93 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.438 ' CE2' ' HG3' ' A' ' 43' ' ' LYS . 14.9 m-85 -97.78 -49.96 4.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.828 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 63.61 126.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.901 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -57.97 132.17 52.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.92 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 41.2 p-80 -139.21 148.59 57.74 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.89 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo . . . . . 0 C--N 1.345 0.355 0 C-N-CA 122.485 2.123 . . . . 0.0 112.329 179.92 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.748 0.309 . . . . 0.0 110.881 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -126.1 153.81 43.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.807 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 29.4 mtt85 -164.0 139.56 6.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.906 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.78 137.52 54.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.861 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.9 p -140.85 171.62 13.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.894 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -115.69 82.32 1.74 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.828 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -59.77 -30.41 68.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.032 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -136.1 149.99 69.85 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.903 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.31 129.17 30.33 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.583 2.189 . . . . 0.0 112.318 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 62.42 29.96 17.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.931 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.6 mp -139.72 118.32 12.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.925 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.91 173.07 8.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.535 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 48.0 tp -164.47 99.34 0.81 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.985 0.421 . . . . 0.0 111.474 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.42 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 40.0 t -96.76 124.14 49.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.896 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 7.5 p90 -138.48 155.99 47.94 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.034 0.445 . . . . 0.0 111.409 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -130.58 116.07 17.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.455 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.429 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.4 mp -84.85 128.02 39.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.934 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.401 ' HB2' ' CG ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -102.98 101.65 11.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.672 179.818 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.2 mtmt -58.55 -23.15 57.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.255 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.401 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 1.0 OUTLIER -52.9 -32.44 45.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.818 0.342 . . . . 0.0 111.01 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -145.2 16.48 1.53 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.307 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 45.97 71.76 0.27 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.805 0.336 . . . . 0.0 111.448 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.5 m -131.4 144.73 51.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.145 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 50.8 tp -101.27 89.66 3.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.41 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -89.98 120.79 31.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.804 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.2 mt -69.98 179.76 2.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.738 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.42 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 62.1 t -150.28 -66.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.094 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 -127.2 163.07 24.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.993 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.2 tt -168.86 152.54 5.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.044 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 121.82 -168.21 14.55 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.47 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 16.0 t -95.51 171.33 8.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.785 0.326 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -80.56 -30.65 37.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.876 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 91.0 p -85.09 -42.65 14.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.016 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -61.55 -38.73 88.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.84 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.88 -179.973 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.805 0.336 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.42 -175.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.865 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -131.1 121.18 48.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.115 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -118.64 167.9 11.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.75 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 59.7 p -142.1 151.1 42.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.963 0.411 . . . . 0.0 110.97 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.417 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 0.3 OUTLIER -112.74 -167.03 1.13 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.98 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.77 -49.32 14.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.856 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.9 mttp -61.22 -31.27 71.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.967 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -71.02 -47.07 60.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.939 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.32 -45.24 94.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.931 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.2 pttt -72.61 -16.04 61.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.375 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -84.43 -29.19 26.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.742 0.306 . . . . 0.0 111.108 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.6 mt -80.24 -36.47 34.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.071 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.8 pttt -58.67 -25.69 63.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.137 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.1 mm -85.13 -29.51 6.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.277 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.1 mt -82.89 -37.13 24.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.05 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.4 p -58.21 -30.4 39.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.051 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -30.75 34.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.916 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -98.76 31.04 3.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.86 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.01 94.3 0.75 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.571 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -175.13 100.61 0.08 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.737 0.303 . . . . 0.0 110.868 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.22 -177.51 0.53 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.905 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 40.3 mt -110.78 -31.32 7.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.963 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.26 -27.85 66.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.06 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.2 pp -57.17 -43.74 82.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.038 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.08 -48.25 82.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.974 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -62.23 -20.12 63.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.081 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -88.32 -29.96 19.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.999 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 34.0 t -81.97 -26.36 9.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.28 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 28.1 m -54.26 -31.65 22.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.285 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.24 -32.17 83.22 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.419 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -90.01 -28.4 19.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.673 0.273 . . . . 0.0 110.85 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 72.1 mt -62.23 -39.73 93.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.898 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.37 -41.13 85.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.103 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.3 p -77.85 -36.61 49.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.893 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 61.25 43.71 10.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.053 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.414 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -92.83 -52.67 0.26 Allowed Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.211 -179.898 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.414 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 72.6 Cg_endo -84.12 -91.57 0.0 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.548 2.165 . . . . 0.0 112.783 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mt 57.87 36.27 26.17 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.83 0.348 . . . . 0.0 110.876 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 64.0 132.97 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.026 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -77.87 -1.16 11.34 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.571 2.181 . . . . 0.0 112.825 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.421 ' HG2' ' CD2' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -109.51 16.79 22.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.35 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.421 ' CD2' ' HG2' ' A' ' 43' ' ' LYS . 43.6 m-85 -146.49 -65.9 0.29 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.85 0.357 . . . . 0.0 110.871 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.1 mtpp 62.6 121.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.912 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -57.96 143.77 41.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.991 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.429 ' CG ' ' HD2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -154.61 156.33 31.44 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.797 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.429 ' HD2' ' CG ' ' A' ' 47' ' ' HIS . 43.1 Cg_endo . . . . . 0 C--N 1.344 0.342 0 C-N-CA 122.577 2.184 . . . . 0.0 112.332 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 . . . . . 0 N--CA 1.457 -0.104 0 CA-C-O 120.877 0.37 . . . . 0.0 110.802 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -88.42 153.65 21.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.982 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -164.04 147.08 9.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.712 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -131.45 134.2 45.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.993 0.425 . . . . 0.0 111.151 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 25.0 p -125.46 -175.25 3.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.645 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -135.85 81.7 1.9 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.21 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.413 ' HG ' ' N ' ' A' ' 62' ' ' LYS . 1.3 pt? -59.93 -33.35 71.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.797 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.435 ' HG3' ' HD2' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -113.6 141.57 26.21 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.341 179.74 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.435 ' HD2' ' HG3' ' A' ' 62' ' ' LYS . 9.4 Cg_endo -52.38 -20.46 11.62 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.651 2.234 . . . . 0.0 112.784 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -130.25 36.75 3.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.193 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.403 ' HB2' ' HB3' ' A' ' 62' ' ' LYS . 56.1 mt -151.82 164.86 36.15 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.944 0.402 . . . . 0.0 111.201 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -126.28 179.81 5.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.125 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.2 tt -170.03 102.92 0.3 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.822 0.344 . . . . 0.0 111.301 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.402 ' O ' ' N ' ' A' ' 81' ' ' VAL . 21.8 t -89.78 138.19 19.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.312 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -147.04 177.15 9.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.074 0.464 . . . . 0.0 111.344 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -148.0 123.04 10.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.474 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 3.0 mm -84.69 138.41 19.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.342 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.77 87.63 2.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.657 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -22.11 21.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.177 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -46.73 -33.53 4.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.2 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -147.2 20.04 1.23 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.318 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 29.7 m120 48.21 69.33 0.56 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.872 0.368 . . . . 0.0 111.232 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 52.2 m -135.1 137.68 43.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.966 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 35.9 tp -94.53 93.22 7.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.591 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.8 t80 -89.89 111.78 22.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.834 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -71.96 171.53 11.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.88 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.402 ' N ' ' O ' ' A' ' 68' ' ' VAL . 66.0 t -137.61 -72.72 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.162 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.0 mmm-85 -116.19 170.56 8.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.922 0.391 . . . . 0.0 111.047 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 9.4 tt -177.62 135.16 0.18 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.771 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 146.38 -168.68 27.78 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.558 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -96.47 144.24 26.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.816 0.341 . . . . 0.0 110.812 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -35.41 73.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.948 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 31.9 m -77.01 -47.1 21.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.96 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.46 -51.04 71.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.955 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.863 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.46 0.048 0 CA-C-O 120.815 0.341 . . . . 0.0 110.867 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.4 -171.89 2.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.89 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -130.76 126.72 60.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.165 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -124.73 166.49 16.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.846 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 71.3 p -142.0 159.68 41.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.962 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -125.49 172.49 9.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.98 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -44.71 96.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.965 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.6 mttm -62.93 -31.25 72.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.769 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.418 ' CZ ' HD13 ' A' ' 14' ' ' LEU . 76.4 t80 -67.94 -34.88 77.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.839 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -69.77 -30.12 67.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.041 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.85 -21.07 55.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.259 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.44 -46.36 9.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.807 0.337 . . . . 0.0 111.036 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.418 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 1.4 tp -63.43 -37.62 87.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.079 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.3 ptpt -57.44 -22.95 46.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.269 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 26.9 mm -85.88 -36.65 10.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.312 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.8 mt -78.58 -35.54 45.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.152 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.0 p -58.16 -33.28 46.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.144 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt -74.87 -30.47 61.33 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.921 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -102.38 30.02 4.84 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.856 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.74 92.53 1.01 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.548 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -176.76 94.96 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.796 0.331 . . . . 0.0 110.861 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.12 -179.06 0.7 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.887 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.2 mp -108.08 -31.74 7.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.851 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.42 -26.03 63.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.042 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.9 pp -56.6 -38.3 71.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.132 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.4 tt -64.1 -37.35 87.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.918 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.63 -27.0 65.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.031 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.68 -31.67 20.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.885 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 24.6 t -67.07 -21.76 28.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.342 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.2 p -49.98 -29.35 5.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.286 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -71.1 -38.54 63.59 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.46 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -79.81 -26.15 40.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.804 0.335 . . . . 0.0 110.911 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 77.6 mt -73.49 -29.06 62.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.946 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.33 -29.72 42.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.251 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.0 p -96.38 -38.88 9.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.048 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 60.89 72.71 0.51 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.792 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.08 -54.31 0.17 Allowed Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.634 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -83.69 -79.26 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.305 2.004 . . . . 0.0 113.111 -179.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.2 mm? 46.7 40.73 9.11 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.846 0.355 . . . . 0.0 111.444 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.403 ' HA ' ' HD3' ' A' ' 42' ' ' PRO . . . 63.2 127.31 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.254 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 41' ' ' ALA . 25.6 Cg_exo -62.43 -25.63 76.19 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.494 2.129 . . . . 0.0 112.418 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -30.94 58.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.325 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -108.15 -62.6 1.43 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.054 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.9 mttt 63.72 31.35 14.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.804 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.7 t70 59.89 161.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.944 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -171.26 161.26 5.28 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.766 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--N 1.344 0.317 0 C-N-CA 122.551 2.167 . . . . 0.0 112.322 179.912 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 . . . . . 0 N--CA 1.457 -0.077 0 CA-C-O 120.888 0.375 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -60.76 156.27 17.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.83 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.2 mtm-85 -165.78 175.58 8.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.859 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -159.65 118.78 2.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.918 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.2 p -121.71 -176.88 3.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.852 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.405 ' CE1' HD21 ' A' ' 66' ' ' LEU . 7.3 m-70 -133.84 86.21 2.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.899 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.0 pp -59.11 -33.42 70.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.862 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.6 mtmt -111.4 167.31 9.25 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.77 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.29 -12.85 37.32 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.501 2.134 . . . . 0.0 112.482 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -154.7 54.42 0.67 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.727 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -151.04 125.69 9.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.908 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.405 HD21 ' CE1' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -91.87 161.53 14.8 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.612 179.709 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.409 HD22 ' CD1' ' A' ' 69' ' ' TYR . 5.7 tt -160.5 94.1 1.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.911 0.386 . . . . 0.0 111.112 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.406 ' O ' ' N ' ' A' ' 81' ' ' VAL . 34.7 t -89.96 136.33 24.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.341 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.409 ' CD1' HD22 ' A' ' 67' ' ' LEU . 11.9 p90 -154.39 154.03 32.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.852 0.358 . . . . 0.0 111.272 -179.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.79 123.01 24.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.783 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.424 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.5 mp -88.42 126.81 41.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.784 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.59 99.7 11.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.681 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.69 -23.05 26.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.204 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 -50.97 -34.63 29.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.909 0.385 . . . . 0.0 111.047 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -143.89 16.82 1.77 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.202 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 m120 47.62 68.74 0.61 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.757 0.313 . . . . 0.0 111.343 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 97.9 m -128.32 138.68 52.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.052 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.409 HD23 ' CD2' ' A' ' 69' ' ' TYR . 1.2 tt -95.74 92.06 6.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.721 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.413 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 3.9 t80 -91.48 118.03 30.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.882 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.413 ' O ' ' CE1' ' A' ' 79' ' ' PHE . 4.8 mt -76.14 179.38 5.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.69 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.406 ' N ' ' O ' ' A' ' 68' ' ' VAL . 90.9 t -150.36 -73.89 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.113 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.4 mtp85 -98.03 167.86 10.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.956 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -178.3 90.14 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.876 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 176.49 175.74 44.08 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.402 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.9 t -98.01 151.58 20.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.901 0.381 . . . . 0.0 110.842 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -68.04 -47.58 68.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.922 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 29.7 p -60.54 -31.89 70.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.858 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.86 -60.52 2.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.872 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.8 mp . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.887 179.998 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.831 0.348 . . . . 0.0 110.891 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -178.52 0.05 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.964 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -127.81 120.93 55.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.132 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -112.56 165.5 12.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.735 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 71.6 p -134.47 149.65 50.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.056 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.427 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 1.4 t -105.43 -172.24 2.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.936 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -75.96 -54.72 6.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.821 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -64.46 -33.17 75.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.799 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.422 ' CZ ' HD11 ' A' ' 80' ' ' LEU . 89.6 t80 -61.93 -30.09 70.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.906 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -68.99 -53.29 21.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.038 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.5 ptmm? -70.84 -10.37 59.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.48 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -85.82 -27.97 24.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.713 0.292 . . . . 0.0 110.946 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tp -83.44 -34.79 25.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.058 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.9 pttt -59.02 -29.24 67.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.169 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.2 mm -76.08 -39.46 36.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.327 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.7 mt -70.76 -44.22 67.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.014 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.1 p -59.76 -28.42 40.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.066 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -78.44 -30.51 47.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.887 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -87.27 -39.8 15.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.966 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 159.56 76.14 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.601 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -147.05 165.84 28.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.808 0.337 . . . . 0.0 110.862 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -125.3 165.98 17.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.963 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.9 mp -90.28 -54.25 4.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.8 mmtt -58.24 -22.96 54.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.1 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -54.21 -52.74 60.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.033 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.6 -30.65 70.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.96 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -73.24 -26.45 61.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.085 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.23 -33.79 24.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.005 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 41.0 t -71.59 -16.82 19.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.447 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.2 t -49.53 -28.33 3.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 120.828 0.347 . . . . 0.0 111.26 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -73.5 -26.72 69.2 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.42 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -90.11 -29.3 18.41 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.758 0.313 . . . . 0.0 110.857 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.3 mt -66.04 -37.92 87.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.904 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.47 -31.61 60.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.111 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 43.4 p -82.51 -44.03 16.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.853 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 61.29 51.9 4.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.945 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -93.55 -53.02 0.25 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.139 -179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -85.12 -88.97 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.513 2.142 . . . . 0.0 112.726 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 56.17 28.79 13.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.801 0.334 . . . . 0.0 111.127 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 61.66 116.44 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.053 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -66.85 -26.27 44.8 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.424 2.083 . . . . 0.0 112.324 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.71 -30.82 71.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.986 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -108.71 -59.51 1.87 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.956 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.4 mttm 63.99 134.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.944 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -66.73 155.15 38.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.954 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 10.9 p-80 -171.48 156.18 4.29 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.897 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo . . . . . 0 C--N 1.344 0.323 0 C-N-CA 122.616 2.211 . . . . 0.0 112.19 179.959 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.82 0.343 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -74.94 141.72 44.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.858 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.3 mtt180 -156.74 152.91 27.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.849 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -131.39 149.5 52.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.025 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 32.1 p -139.54 -173.25 3.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.778 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 75.9 m-70 -138.86 85.04 2.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.948 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.1 pp -64.81 -41.08 96.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.816 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 mttt -102.65 166.61 11.65 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.833 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.85 -12.28 34.85 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.576 2.184 . . . . 0.0 112.425 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -154.33 52.05 0.66 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.888 0.375 . . . . 0.0 110.614 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -152.6 127.78 9.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.955 -179.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.92 166.33 13.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.502 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 43.9 tp -159.46 98.57 1.41 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.967 0.413 . . . . 0.0 111.614 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.439 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 19.9 t -95.08 124.74 47.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.691 178.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.462 ' CD1' ' CD1' ' A' ' 71' ' ' ILE . 7.8 p90 -141.18 163.39 33.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.128 0.49 . . . . 0.0 111.534 -179.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -141.66 107.62 5.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.399 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.462 ' CD1' ' CD1' ' A' ' 69' ' ' TYR . 1.5 mp -84.88 146.28 6.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.014 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.17 104.72 10.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.693 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -59.96 -21.02 60.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.176 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.1 tp-100 -52.46 -33.6 45.2 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.104 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -144.32 17.19 1.7 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.268 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 47.38 74.79 0.15 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.894 0.378 . . . . 0.0 111.234 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 82.3 m -134.46 148.72 50.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.996 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.2 tt -107.67 93.04 4.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.63 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.427 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.7 t80 -89.99 105.74 18.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.991 -179.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.422 HD11 ' CZ ' ' A' ' 10' ' ' PHE . 3.8 mt -65.73 -179.38 0.67 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.521 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.439 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 59.9 t -154.81 -59.53 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.24 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.25 165.95 11.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.85 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.415 ' HB2' ' CE1' ' A' ' 10' ' ' PHE . 0.2 OUTLIER -177.84 99.16 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.963 -179.944 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 165.29 -161.39 34.8 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.39 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.2 p -123.03 155.51 36.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.751 0.31 . . . . 0.0 110.976 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -69.17 -31.53 70.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.97 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.1 t -74.78 -34.98 62.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.945 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.93 -57.2 4.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.898 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.971 179.916 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.035 0 CA-C-O 120.822 0.344 . . . . 0.0 110.844 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.26 -173.61 4.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.882 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.4 mp -139.9 112.98 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.99 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -112.41 162.45 15.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.749 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 74.4 p -141.95 143.3 33.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.074 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.27 175.28 9.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.968 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.5 mtmt -64.79 -45.74 85.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.836 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -61.14 -21.71 64.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.092 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.418 ' CZ ' ' HB2' ' A' ' 83' ' ' LEU . 1.0 OUTLIER -65.31 -32.45 74.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.004 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.12 -44.43 79.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.935 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.23 -8.85 59.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.371 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.14 -27.27 19.72 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.669 0.271 . . . . 0.0 111.257 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.9 -41.71 11.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.462 -179.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.6 pttm -54.67 -24.31 21.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.345 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.2 mm -83.43 -32.16 8.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.108 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 91.2 mt -82.03 -38.05 25.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.051 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.0 p -59.27 -30.48 44.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.115 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.31 -45.89 24.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.819 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -71.66 -31.6 67.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.82 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 149.56 75.98 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.543 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -153.7 165.46 35.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.876 0.369 . . . . 0.0 110.907 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -145.51 164.5 31.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.821 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.6 mp -94.77 -29.04 14.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.948 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -33.35 69.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.919 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.4 pp -74.1 -30.66 62.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.021 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 7.3 tt -73.78 -25.99 60.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.137 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -81.01 -28.58 35.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.094 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.73 -36.11 17.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.042 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.1 p -62.6 -21.12 26.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.392 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 27.8 m -47.68 -32.56 2.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.834 0.349 . . . . 0.0 111.462 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.83 -26.52 74.29 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.474 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -89.88 -27.38 19.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.744 0.307 . . . . 0.0 110.967 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 69.2 mt -66.49 -43.93 84.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.015 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.03 -37.43 72.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.276 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 53.3 p -78.7 -41.44 31.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.021 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 62.08 49.95 4.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.87 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.458 ' H ' ' HD2' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -98.76 -61.76 0.11 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.641 -179.827 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.458 ' HD2' ' H ' ' A' ' 38' ' ' GLN . 30.1 Cg_endo -63.66 -85.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.274 1.983 . . . . 0.0 112.958 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.1 mm? 47.61 -173.1 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.801 0.334 . . . . 0.0 111.376 -179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -105.25 145.64 31.16 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.12 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.72 -28.92 7.62 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.618 2.212 . . . . 0.0 112.352 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -76.71 -27.28 55.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.044 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.501 ' CD2' ' CG ' ' A' ' 60' ' ' HIS . 19.8 m-85 -105.29 -54.6 2.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.926 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.92 147.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.803 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -87.19 134.53 33.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.976 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -173.22 162.44 3.48 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.857 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo . . . . . 0 C--N 1.345 0.355 0 C-N-CA 122.583 2.189 . . . . 0.0 112.264 -179.994 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 . . . . . 0 C--O 1.23 0.046 0 CA-C-O 120.843 0.354 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -89.89 137.42 32.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.844 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.3 mtt180 -154.34 148.64 26.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.862 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -118.2 150.04 40.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.04 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 30.4 p -148.47 151.41 35.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.857 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.501 ' CG ' ' CD2' ' A' ' 44' ' ' TYR . 17.2 m-70 -107.83 92.42 4.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.899 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.3 pp -68.04 -30.87 70.19 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.782 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.401 ' HG3' ' HD2' ' A' ' 63' ' ' PRO . 33.2 tptt -140.24 139.55 21.23 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.61 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.401 ' HD2' ' HG3' ' A' ' 62' ' ' LYS . 96.8 Cg_exo -43.44 132.96 7.07 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.565 2.177 . . . . 0.0 112.419 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 65.87 25.58 11.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.799 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.81 120.0 9.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.712 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -101.43 -178.25 3.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.679 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.8 tt -167.92 103.55 0.48 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.071 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.418 ' O ' ' N ' ' A' ' 81' ' ' VAL . 24.8 t -94.88 138.98 19.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.543 179.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -147.85 161.95 40.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 0.0 111.31 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -128.52 120.24 26.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.438 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 3.0 mm -84.71 141.51 14.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.38 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.45 87.5 2.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.695 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -56.39 -22.53 32.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.248 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -50.11 -32.82 16.83 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.891 0.377 . . . . 0.0 111.118 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -142.9 16.6 1.95 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.179 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 47.43 68.3 0.67 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.843 0.354 . . . . 0.0 111.22 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 88.7 m -133.41 136.29 45.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.911 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 34.3 tp -95.06 92.37 6.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.727 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -90.08 115.74 27.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.966 -179.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.405 ' HB3' ' CE2' ' A' ' 10' ' ' PHE . 30.6 mt -73.27 171.52 12.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.742 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.418 ' N ' ' O ' ' A' ' 68' ' ' VAL . 57.9 t -133.51 -70.22 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.291 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -118.45 175.78 5.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.117 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.418 ' HB2' ' CZ ' ' A' ' 10' ' ' PHE . 0.4 OUTLIER -173.47 90.96 0.08 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.849 -179.983 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.62 127.92 1.49 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.749 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.33 154.91 4.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.829 0.347 . . . . 0.0 111.127 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.84 -33.59 75.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.897 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.36 -32.35 60.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.875 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -67.18 -48.06 69.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.912 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.823 179.985 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.828 0.347 . . . . 0.0 110.808 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.96 -176.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.015 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -136.36 115.26 15.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.994 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -108.64 159.68 16.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.813 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 39.9 p -139.19 150.05 45.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.926 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.41 ' HB2' ' CZ ' ' A' ' 79' ' ' PHE . 0.1 OUTLIER -118.19 -168.83 1.59 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.944 179.975 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -78.07 -46.08 21.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.898 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -61.47 -33.79 74.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.416 ' CZ ' HD12 ' A' ' 14' ' ' LEU . 13.2 t80 -69.88 -37.68 76.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -72.94 -29.52 63.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.978 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -76.22 -23.19 54.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.153 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.37 -46.79 11.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.069 -179.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.416 HD12 ' CZ ' ' A' ' 10' ' ' PHE . 81.0 mt -59.79 -37.46 79.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.096 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt -56.95 -26.83 60.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.141 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.414 HG23 HD12 ' A' ' 16' ' ' ILE . 25.9 mm -82.45 -33.65 11.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.172 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.3 mt -79.99 -41.3 26.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.033 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.6 p -57.84 -29.55 35.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.157 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.2 tttt -81.21 -31.22 34.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.93 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -100.43 30.39 3.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.971 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.11 95.3 0.81 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.592 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.409 ' CZ ' HD13 ' A' ' 26' ' ' LEU . 11.4 t80 -176.6 113.39 0.1 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.814 0.34 . . . . 0.0 110.831 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.405 ' O ' ' CD1' ' A' ' 22' ' ' PHE . 5.0 m-20 -74.85 160.39 30.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.956 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.82 -28.2 14.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.993 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.9 mtmm -69.23 -29.6 67.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.957 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.409 HD13 ' CZ ' ' A' ' 22' ' ' PHE . 4.4 pp -58.6 -30.97 67.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.953 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.99 -23.91 55.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.159 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -82.44 -30.55 29.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.785 0.326 . . . . 0.0 111.003 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -88.31 -33.46 18.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.031 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.8 p -62.74 -21.52 27.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.321 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 36.1 t -47.5 -38.33 5.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.293 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.27 -32.57 84.64 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.387 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -89.99 -23.19 21.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.748 0.309 . . . . 0.0 111.173 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.3 mt -69.77 -40.44 76.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.054 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.8 -36.6 67.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.276 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.7 p -83.32 -42.5 17.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.93 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.413 ' HA ' ' CD1' ' A' ' 40' ' ' LEU . 13.3 mt-10 61.04 58.67 2.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.857 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.4 ' N ' ' CD ' ' A' ' 39' ' ' PRO . 0.5 OUTLIER -88.71 -51.74 0.38 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.517 -179.65 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.4 ' CD ' ' N ' ' A' ' 38' ' ' GLN . 63.1 Cg_endo -77.82 -91.29 0.0 OUTLIER 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 122.174 1.916 . . . . 0.0 112.696 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.413 ' CD1' ' HA ' ' A' ' 37' ' ' GLU . 3.1 mp 56.51 -178.85 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.801 0.334 . . . . 0.0 111.038 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -94.78 142.15 24.3 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.0 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -74.73 -24.47 13.39 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.553 2.169 . . . . 0.0 112.47 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.54 -29.23 26.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.093 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -95.36 -62.11 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.109 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 mmtt 62.33 149.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.847 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.4 ' HB2' ' CD2' ' A' ' 40' ' ' LEU . 40.8 t0 -93.72 142.5 27.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.997 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.5 p-80 -154.85 142.29 13.85 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.76 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo . . . . . 0 C--N 1.344 0.312 0 C-N-CA 122.482 2.121 . . . . 0.0 112.405 -179.863 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.839 0.352 . . . . 0.0 110.947 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -62.3 139.49 58.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.857 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 56.1 mtm180 -154.65 135.45 13.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.847 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -110.39 119.18 38.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.849 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 24.7 p -127.0 144.61 50.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.781 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -108.06 83.17 1.75 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.028 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 pp -59.04 -32.41 69.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.671 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.413 ' CB ' ' HD2' ' A' ' 63' ' ' PRO . 0.3 OUTLIER -113.62 170.06 5.77 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.679 179.815 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.413 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 55.1 Cg_endo -70.1 -8.38 23.47 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.384 2.056 . . . . 0.0 112.781 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -151.43 40.69 0.69 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.739 0.304 . . . . 0.0 111.137 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 27.4 mt -131.59 133.7 45.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.052 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.96 116.16 28.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.716 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -113.97 94.62 4.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.998 0.428 . . . . 0.0 111.143 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.536 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 26.2 t -96.84 69.87 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.841 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.425 ' CE1' HD12 ' A' ' 71' ' ' ILE . 3.1 p90 -89.51 177.14 6.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.098 0.475 . . . . 0.0 111.345 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -146.15 122.51 10.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.709 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.428 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.5 mp -92.65 138.17 20.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.852 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.09 102.5 11.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.658 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.63 -20.5 56.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.263 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -52.88 -29.42 28.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.734 0.302 . . . . 0.0 111.081 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -149.23 19.13 0.96 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.277 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 34.8 m120 46.46 74.77 0.14 Allowed 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.731 0.3 . . . . 0.0 111.303 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 53.9 m -133.81 147.45 51.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.165 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.4 95.59 5.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.553 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.41 ' CZ ' ' HB2' ' A' ' 7' ' ' SER . 5.4 t80 -89.9 111.65 22.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.866 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -68.23 168.96 11.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.607 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.536 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 98.3 t -152.02 -84.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.432 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 11.1 mtm-85 -96.23 160.44 14.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.865 0.364 . . . . 0.0 111.254 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -179.64 114.22 0.05 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.612 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 145.55 -159.93 28.0 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.42 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.22 141.05 51.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.809 0.338 . . . . 0.0 110.828 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -58.95 -30.35 67.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.914 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.1 m -78.23 -32.68 49.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.922 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -70.0 -46.88 64.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.958 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.0 mp . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.92 179.95 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.901 0.382 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.51 -175.57 0.27 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.841 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.2 mp -133.37 116.19 24.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.108 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -110.19 168.18 9.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.81 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 77.6 p -138.41 147.93 43.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.894 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.409 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 2.6 t -105.71 -168.19 1.42 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.886 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -74.53 -58.18 3.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.966 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -58.88 -34.56 71.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.964 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -60.29 -34.86 74.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.927 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.32 -35.02 63.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.862 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.7 mtpp -82.11 -20.96 37.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.087 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -84.1 -28.44 27.52 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.139 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -83.8 -36.49 23.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.161 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 12.6 pttp -58.6 -29.98 66.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.055 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.42 HG21 HD12 ' A' ' 16' ' ' ILE . 27.4 mm -83.62 -33.24 9.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.118 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.1 mt -73.68 -43.14 60.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.912 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.2 p -60.24 -30.93 47.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.11 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -72.92 -33.74 66.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.804 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -84.97 -48.74 8.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.927 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 163.3 76.95 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.501 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.421 ' CZ ' HD13 ' A' ' 26' ' ' LEU . 56.4 t80 -153.07 116.8 4.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.858 0.361 . . . . 0.0 110.908 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.47 156.13 24.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.866 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.3 mp -91.36 -29.93 16.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.913 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -58.81 -36.87 75.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.97 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.421 HD13 ' CZ ' ' A' ' 22' ' ' PHE . 3.9 pp -66.35 -30.67 71.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.885 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 9.1 tp -71.71 -29.07 64.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.983 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -83.21 -25.22 31.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.956 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 mttt -88.04 -34.45 17.99 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.075 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.4 p -60.28 -19.63 18.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.331 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 29.4 m -48.7 -41.06 12.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.827 0.346 . . . . 0.0 111.362 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.66 -27.5 66.42 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.371 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -89.29 -30.01 18.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 0.0 110.871 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.3 mt -63.38 -38.07 89.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.873 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.93 -51.97 14.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.079 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.5 p -66.35 -44.54 82.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.917 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 60.42 51.92 5.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.891 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.41 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 0.5 OUTLIER -91.31 -52.12 0.3 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.233 -179.841 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.41 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 74.3 Cg_endo -84.18 -92.13 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.406 2.071 . . . . 0.0 112.684 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 54.55 36.78 26.63 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-O 120.849 0.357 . . . . 0.0 111.143 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.54 127.95 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.08 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -77.27 -3.4 13.65 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.482 2.121 . . . . 0.0 112.832 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -102.63 -32.38 9.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 0.0 111.023 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -95.25 -52.68 4.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.904 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.2 mmtt 62.69 148.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.794 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 59.5 t0 -91.51 139.56 30.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.949 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 11.8 p-80 -158.42 146.42 13.78 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.79 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo . . . . . 0 C--N 1.346 0.398 0 C-N-CA 122.532 2.155 . . . . 0.0 112.337 179.979 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.768 0.318 . . . . 0.0 111.029 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -78.02 143.98 37.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.832 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -156.4 142.8 18.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.595 -179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -128.5 148.89 50.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.124 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 32.1 p -137.15 -172.46 3.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.631 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 28.3 m-70 -143.73 85.84 1.85 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.981 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.01 -43.43 98.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.75 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.51 166.36 13.03 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.859 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.39 -3.53 14.02 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.749 2.299 . . . . 0.0 112.972 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -147.59 33.83 0.86 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.609 0.242 . . . . 0.0 111.08 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 mp -151.84 145.59 25.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.903 0.382 . . . . 0.0 111.098 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -110.53 -173.19 2.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.293 179.602 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.4 HD21 ' CD1' ' A' ' 80' ' ' LEU . 4.1 tt -169.99 103.58 0.31 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.876 0.37 . . . . 0.0 111.431 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.404 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 13.7 t -94.66 120.95 44.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.09 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -137.78 159.54 41.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.004 0.431 . . . . 0.0 111.433 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -132.42 122.74 25.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.505 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 3.0 mm -84.74 131.04 34.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.41 -179.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.82 85.02 2.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.665 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.0 mttt -56.19 -23.02 32.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.264 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -51.97 -30.38 24.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.845 0.355 . . . . 0.0 111.047 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -142.25 16.47 2.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.311 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 47.05 69.31 0.51 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.858 0.361 . . . . 0.0 111.311 179.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 49.3 m -139.13 143.67 38.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.067 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.29 96.45 8.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.668 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.409 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 3.7 t80 -94.39 114.19 26.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.945 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.408 ' O ' ' CE1' ' A' ' 79' ' ' PHE . 3.0 mm? -69.62 169.86 11.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.797 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.404 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 35.1 t -136.41 -63.66 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.069 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.8 ttt85 -133.07 172.52 12.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.914 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.9 tt -176.84 146.53 0.55 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.949 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.94 129.52 6.64 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.488 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -52.68 138.93 27.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.84 0.352 . . . . 0.0 111.09 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -30.12 66.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.936 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.9 p -64.65 -32.96 74.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -73.73 -44.81 55.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.91 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.0 mp . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 -179.982 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.1 mt . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.763 0.316 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.39 -177.32 1.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.862 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.8 mp -133.8 116.91 24.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.196 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -110.49 159.81 17.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.712 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 34.2 p -130.93 149.85 52.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.115 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.9 t -106.13 -166.8 1.23 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.8 mtmm -82.85 -52.09 7.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.027 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.4 mmtp -70.24 -31.77 69.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.027 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.428 ' CZ ' ' HG ' ' A' ' 80' ' ' LEU . 76.4 t80 -59.95 -53.66 55.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.884 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.29 -31.03 68.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.988 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -82.35 -20.03 38.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.179 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -85.37 -28.36 25.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.19 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.412 HD12 ' CZ ' ' A' ' 10' ' ' PHE . 3.9 mp -81.59 -37.65 27.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.162 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.1 ptpt -58.27 -29.77 66.07 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.089 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.1 mm -81.05 -43.81 20.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.069 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.405 ' HB3' ' CD2' ' A' ' 22' ' ' PHE . 2.1 mm? -56.62 -26.84 56.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.924 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.6 t -57.41 -54.59 28.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.126 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.1 tptm -59.18 -28.67 66.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.08 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -97.84 33.57 2.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.973 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.79 88.35 0.38 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.486 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.42 ' CE1' HD12 ' A' ' 26' ' ' LEU . 7.4 t80 -176.56 166.84 2.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.74 0.305 . . . . 0.0 110.838 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -157.01 158.99 37.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.912 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -88.39 -29.68 20.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.003 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -63.58 -45.2 91.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.906 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.42 HD12 ' CE1' ' A' ' 22' ' ' PHE . 4.3 pp -60.1 -31.63 70.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.921 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.7 tt -76.26 -28.7 57.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.913 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.11 -29.49 67.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.907 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.61 -30.85 18.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.055 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 34.6 t -64.38 -22.49 31.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.247 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 29.1 m -50.35 -29.29 6.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.226 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -70.0 -33.74 70.24 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.397 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -86.32 -28.93 23.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.739 0.304 . . . . 0.0 110.881 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.0 mt -63.25 -38.31 90.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.831 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.24 -34.9 61.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.185 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 51.4 p -78.86 -41.35 30.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.837 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.438 ' HA ' HD22 ' A' ' 40' ' ' LEU . 26.8 mt-10 58.07 61.39 2.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.972 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.425 ' CB ' ' HD3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -102.48 -55.18 0.12 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.411 -179.79 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.425 ' HD3' ' CB ' ' A' ' 38' ' ' GLN . 41.7 Cg_endo -86.04 -76.36 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.379 2.053 . . . . 0.0 112.338 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.438 HD22 ' HA ' ' A' ' 37' ' ' GLU . 2.5 mm? 48.65 27.65 1.57 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.814 0.34 . . . . 0.0 111.433 179.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 62.11 121.01 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.116 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.95 -35.78 90.54 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.425 2.084 . . . . 0.0 112.388 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.73 -30.45 68.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.852 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -109.63 63.86 0.61 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.857 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.7 mttp -60.29 102.5 0.18 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.815 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -51.56 145.33 9.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.087 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -168.28 162.97 8.82 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.914 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo . . . . . 0 C--N 1.343 0.253 0 C-N-CA 122.605 2.204 . . . . 0.0 112.353 -179.93 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.742 0.306 . . . . 0.0 111.182 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -94.0 125.35 38.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.882 0.372 . . . . 0.0 110.908 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -145.07 155.26 43.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.783 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -121.66 154.57 36.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.003 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.3 m -145.76 -169.99 3.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.895 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -139.03 110.8 7.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.898 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.402 ' CD2' ' CD1' ' A' ' 67' ' ' LEU . 3.7 pp -83.17 -38.26 22.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.85 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.41 ' CB ' ' HD2' ' A' ' 63' ' ' PRO . 2.7 mttm -108.13 169.36 6.69 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.788 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.41 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 47.5 Cg_endo -68.8 -9.39 26.1 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.466 2.11 . . . . 0.0 112.823 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -150.63 49.43 0.87 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.85 0.357 . . . . 0.0 110.941 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -159.31 140.66 12.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.113 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -101.53 -177.69 3.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.339 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.402 ' CD1' ' CD2' ' A' ' 61' ' ' LEU . 3.0 tt -170.02 102.64 0.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.821 0.343 . . . . 0.0 111.493 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 23.4 t -90.04 125.44 42.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.124 178.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.403 ' HB3' HD11 ' A' ' 80' ' ' LEU . 10.0 p90 -145.06 163.36 34.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.864 0.364 . . . . 0.0 111.422 -179.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.35 119.3 9.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.754 179.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.439 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.5 mp -85.07 146.32 6.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.9 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.52 103.7 10.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.88 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.3 mmtp -56.72 -21.93 31.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.212 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -47.44 -36.6 10.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.804 0.335 . . . . 0.0 111.312 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -148.36 20.99 1.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.194 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 48.96 73.59 0.22 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.853 0.359 . . . . 0.0 111.059 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 99.8 m -132.45 147.4 52.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.915 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.01 91.81 3.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.732 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.42 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 4.3 t80 -89.94 121.11 31.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.833 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.428 ' HG ' ' CZ ' ' A' ' 10' ' ' PHE . 3.0 mm? -76.76 176.08 8.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.74 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 60.5 t -145.35 -66.34 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.144 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 -123.39 169.07 11.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.962 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.7 tt -176.11 134.66 0.26 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.901 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.86 -141.43 10.28 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.591 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.3 m -134.61 175.62 9.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.907 0.385 . . . . 0.0 110.883 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -82.08 -32.58 30.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.4 m -78.65 -32.9 47.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.95 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.38 -58.77 3.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.905 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.83 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.854 0.359 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.36 -174.9 0.57 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.824 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -133.98 120.99 37.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.121 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -115.02 163.84 15.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.737 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.5 p -128.28 155.44 44.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.041 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.412 ' OG ' ' CE1' ' A' ' 79' ' ' PHE . 14.7 m -99.99 -178.37 3.83 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.984 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -74.16 -46.23 43.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.826 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -29.65 69.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.02 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.424 ' CE2' ' HB3' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -58.28 -38.98 78.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.997 179.975 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -61.86 -33.12 73.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.78 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -89.95 -21.63 22.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.139 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -79.59 -25.94 41.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.155 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.1 mp -88.86 -38.44 14.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.26 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 48.6 pttt -57.86 -30.33 65.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.133 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.417 HD11 HG21 ' A' ' 16' ' ' ILE . 27.9 mm -85.19 -29.15 6.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.161 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.0 mt -81.22 -36.82 29.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.916 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.6 p -60.14 -26.21 35.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.111 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -90.09 -42.98 10.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.545 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.09 -30.88 69.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.534 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 147.87 80.35 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.41 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.437 ' CZ ' ' CD1' ' A' ' 26' ' ' LEU . 8.9 t80 -157.57 171.88 19.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.941 0.401 . . . . 0.0 110.942 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -145.51 169.42 18.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.862 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.7 mp -97.67 -27.75 14.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.08 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -66.34 -34.18 77.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.952 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.437 ' CD1' ' CZ ' ' A' ' 22' ' ' PHE . 3.9 pp -64.79 -34.34 78.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.892 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.41 -41.25 56.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.883 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -72.42 -23.67 61.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.2 mmmt -90.04 -31.68 17.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.333 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.7 p -80.8 -7.4 10.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.865 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.5 t -53.94 -42.02 51.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-O 120.778 0.323 . . . . 0.0 111.125 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.81 -27.0 72.33 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.379 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -87.2 -19.41 28.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.589 0.233 . . . . 0.0 111.159 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.5 mt -77.95 -38.29 45.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.918 0.389 . . . . 0.0 110.983 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.81 -33.03 73.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.244 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 71.2 p -97.87 -31.49 12.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 60.86 58.94 2.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.874 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.456 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -75.35 -56.98 1.77 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.44 -179.876 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 25.0 Cg_endo -62.23 -82.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.063 1.842 . . . . 0.0 112.468 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 46.56 97.36 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.121 0 CA-C-O 120.873 0.368 . . . . 0.0 111.549 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.37 146.86 4.38 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.371 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.16 -25.35 19.14 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.564 2.176 . . . . 0.0 112.461 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.3 -28.12 61.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.166 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.41 ' HB3' ' CD2' ' A' ' 60' ' ' HIS . 58.9 m-85 -112.46 -66.79 1.05 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.156 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.3 tttt 63.06 149.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.867 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -76.33 121.46 23.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.841 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -149.22 163.97 23.03 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.899 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo . . . . . 0 C--N 1.343 0.281 0 C-N-CA 122.532 2.154 . . . . 0.0 112.208 179.898 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.802 0.334 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -108.4 145.3 34.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.884 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -159.02 128.4 5.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.747 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -105.88 136.28 45.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.0 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 32.0 p -129.2 149.61 50.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.682 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.412 ' CE1' HD22 ' A' ' 66' ' ' LEU . 34.3 m-70 -107.12 86.05 2.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.142 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.7 pp -59.22 -41.1 87.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.692 179.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -111.98 167.67 8.79 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.748 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.8 -7.59 21.7 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.464 2.109 . . . . 0.0 112.943 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -148.32 42.37 1.0 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.762 0.315 . . . . 0.0 111.161 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 89.7 mt -154.33 135.63 14.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.906 0.384 . . . . 0.0 111.059 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.412 HD22 ' CE1' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -102.46 171.71 7.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.448 179.7 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.6 tt -165.46 100.3 0.71 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.945 0.402 . . . . 0.0 111.356 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.446 ' O ' ' N ' ' A' ' 81' ' ' VAL . 33.6 t -96.18 135.44 30.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.034 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -146.0 161.98 38.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.995 0.426 . . . . 0.0 111.35 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -131.47 124.95 31.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.516 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 2.9 mm -84.6 143.85 10.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.344 -179.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.85 87.72 2.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.714 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.7 pttt -57.69 -22.21 44.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.217 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -51.7 -32.21 29.12 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.847 0.356 . . . . 0.0 110.987 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -141.27 15.22 2.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.219 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.0 t30 47.54 69.91 0.47 Allowed 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 120.84 0.352 . . . . 0.0 111.156 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 76.3 m -137.44 146.12 43.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.986 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 34.1 tp -101.0 92.33 4.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.776 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.412 ' CE1' ' OG ' ' A' ' 7' ' ' SER . 4.2 t80 -90.77 114.02 26.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.86 -179.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.424 ' HB3' ' CE2' ' A' ' 10' ' ' PHE . 2.6 mt -71.48 178.96 3.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.928 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.446 ' N ' ' O ' ' A' ' 68' ' ' VAL . 58.7 t -139.13 -70.85 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.105 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -129.99 171.49 12.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.975 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.7 tt -174.9 152.66 1.56 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.872 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 125.6 -156.99 19.56 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.467 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.3 t -119.99 133.93 55.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.933 0.397 . . . . 0.0 110.885 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -59.76 -47.73 84.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.972 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 25.1 p -64.56 -31.11 72.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.997 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -73.89 -56.51 4.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.3 mp . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.981 -179.899 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.79 0.329 . . . . 0.0 110.85 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -177.4 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.908 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -128.7 106.28 14.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.12 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -103.07 160.97 14.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.803 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.7 p -139.18 151.47 46.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.026 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 16.7 p -109.3 -168.57 1.35 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.821 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.0 -60.01 2.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.924 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.3 mttt -59.91 -33.36 71.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.906 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CE1' ' HB3' ' A' ' 80' ' ' LEU . 75.1 t80 -59.46 -53.5 57.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.935 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.34 -29.96 69.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.028 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -83.47 -6.92 59.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.456 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -89.99 -29.76 18.23 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.689 0.281 . . . . 0.0 111.061 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 pp -84.46 -38.39 20.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.071 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -59.19 -22.15 60.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.228 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.0 mm -88.98 -29.29 5.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.309 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.9 mt -79.79 -32.71 40.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.119 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.5 p -61.97 -30.83 49.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.141 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.65 -37.44 35.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.939 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -77.85 -31.33 51.44 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.869 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 145.58 80.17 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.526 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -153.48 161.16 42.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.831 0.348 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -107.96 172.58 6.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.905 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -99.47 -57.85 2.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.975 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -60.82 -21.5 63.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.053 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -52.73 -54.07 38.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.881 0.372 . . . . 0.0 111.044 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 tt -61.02 -46.32 91.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.827 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -60.65 -25.09 66.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.998 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.68 -29.43 22.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.001 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 25.6 t -67.76 -24.55 30.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.309 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 32.1 m -48.02 -38.95 8.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.852 0.358 . . . . 0.0 111.38 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.23 -27.9 65.98 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.456 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -90.12 -22.45 21.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.662 0.268 . . . . 0.0 111.15 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.3 mt -69.33 -33.08 72.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.833 0.349 . . . . 0.0 110.93 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.75 -32.96 60.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.136 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.0 p -88.67 -46.24 9.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 62.03 55.61 2.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.861 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -93.86 -53.19 0.25 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.225 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -84.63 -88.89 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.49 2.126 . . . . 0.0 112.588 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.57 35.88 26.06 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.889 0.376 . . . . 0.0 111.134 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 60.14 109.4 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.069 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.82 -25.98 38.85 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.365 2.044 . . . . 0.0 112.414 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.3 pttt -66.78 -31.12 71.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.006 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -103.74 -39.3 6.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.933 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.5 mttm 63.61 127.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.879 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -61.39 146.57 47.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.017 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -160.13 150.7 15.38 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.826 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo . . . . . 0 C--N 1.344 0.327 0 C-N-CA 122.5 2.133 . . . . 0.0 112.36 -179.867 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.949 0.404 . . . . 0.0 110.759 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -105.31 118.2 35.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.758 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 23.4 mtp180 -142.63 155.07 44.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.018 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -129.79 143.14 50.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.839 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 21.1 m -134.94 177.43 7.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.837 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -130.18 83.4 2.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.958 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.92 -34.75 65.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.916 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 12.8 mmtt -117.92 163.72 23.2 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.681 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.8 -19.29 30.6 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.654 2.236 . . . . 0.0 112.467 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -148.66 76.38 1.35 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.711 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -175.57 122.13 0.2 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.139 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -89.95 157.03 18.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.2 179.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.6 tt -153.16 98.35 2.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.902 0.382 . . . . 0.0 111.391 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 34.8 t -94.09 134.1 32.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.284 179.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.45 ' CD1' ' CD1' ' A' ' 71' ' ' ILE . 5.1 p90 -146.26 158.28 43.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.996 0.427 . . . . 0.0 111.312 -179.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -135.24 109.35 8.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.637 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.45 ' CD1' ' CD1' ' A' ' 69' ' ' TYR . 1.5 mp -84.97 141.22 14.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.837 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.69 103.54 10.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.72 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm -59.98 -19.71 53.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.417 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -30.34 36.4 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.747 0.308 . . . . 0.0 111.142 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -148.57 19.71 1.04 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.339 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 46.98 75.3 0.13 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.751 0.31 . . . . 0.0 111.283 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 96.6 m -133.99 148.48 51.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.942 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.56 91.46 3.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.66 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 6.1 t80 -89.93 110.96 21.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.92 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.427 ' HB3' ' CE1' ' A' ' 10' ' ' PHE . 3.4 mm? -70.41 -178.01 1.62 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.603 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 82.5 t -152.47 -72.42 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.304 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.08 163.85 11.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.914 0.387 . . . . 0.0 111.096 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -177.09 87.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.926 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 177.7 -136.61 3.1 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.512 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -140.32 147.86 40.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.744 0.307 . . . . 0.0 110.895 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -59.2 -39.8 83.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.062 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.1 t -75.42 -37.49 60.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.976 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.1 -57.82 5.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.922 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.2 mm? . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.856 179.964 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.843 0.354 . . . . 0.0 110.869 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.32 -175.72 2.0 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.793 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.1 mp -130.31 124.18 57.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.003 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -117.2 162.84 17.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.801 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 44.1 p -126.12 153.67 44.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.951 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.7 t -102.87 177.12 4.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.021 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.7 mtmm -74.02 -43.89 56.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.861 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.7 mmtm -79.07 -28.21 43.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.934 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.417 ' CE2' HD12 ' A' ' 80' ' ' LEU . 31.7 t80 -55.83 -34.33 65.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.978 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -68.12 -31.69 71.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.867 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -78.63 -22.02 47.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.166 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.04 -27.34 33.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.107 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.416 HD12 ' CE2' ' A' ' 10' ' ' PHE . 4.8 mt -81.11 -37.77 28.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.106 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 15.7 ptmt -57.47 -28.85 63.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.129 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.9 mm -78.74 -28.72 14.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.328 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 26.5 mt -87.48 -40.68 14.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.115 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.5 p -57.62 -32.17 41.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.2 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt -77.54 -31.17 53.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.935 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -100.37 29.89 4.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.917 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.16 98.44 0.54 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.539 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -176.88 97.86 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.82 0.343 . . . . 0.0 110.932 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -68.83 160.87 29.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.889 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -94.21 -31.0 14.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.894 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.73 -34.86 73.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.977 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.2 pp -61.15 -35.68 77.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.869 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.5 tp -77.07 -29.48 55.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.972 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -79.49 -25.54 41.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.069 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.34 -32.06 17.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.088 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -71.39 -14.32 17.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.582 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.3 m -51.73 -46.35 38.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.841 0.353 . . . . 0.0 111.365 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.65 -26.39 68.41 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.413 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -88.71 -19.59 25.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.637 0.256 . . . . 0.0 111.162 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.7 mt -72.23 -45.93 58.2 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.842 0.353 . . . . 0.0 111.012 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.83 -30.59 71.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.23 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 73.5 p -92.38 -35.61 13.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.899 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.423 ' HA ' HD22 ' A' ' 40' ' ' LEU . 17.8 mt-10 60.01 61.59 1.84 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.874 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.46 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 2.5 mt-30 -79.94 -56.67 0.73 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.564 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.46 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 36.5 Cg_endo -66.27 -86.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.029 1.819 . . . . 0.0 112.327 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.423 HD22 ' HA ' ' A' ' 37' ' ' GLU . 3.6 mm? 44.63 92.64 0.01 OUTLIER 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.775 0.321 . . . . 0.0 111.625 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.404 ' CB ' ' HD2' ' A' ' 42' ' ' PRO . . . -59.33 165.63 3.69 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.404 ' HD2' ' CB ' ' A' ' 41' ' ' ALA . 11.2 Cg_endo -54.6 -68.95 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.522 2.148 . . . . 0.0 112.196 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.04 -30.65 71.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.753 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -108.56 55.08 0.64 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.693 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.96 -162.22 0.94 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.766 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -113.2 155.2 25.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.869 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 11.3 p-80 -165.6 145.42 5.5 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.825 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo . . . . . 0 C--N 1.346 0.404 0 C-N-CA 122.597 2.198 . . . . 0.0 112.298 179.972 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.9 t0 . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.8 0.333 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.402 ' CD1' ' HB2' ' A' ' 70' ' ' GLN . 10.1 m-85 -64.85 157.93 26.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.9 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.2 mtt85 -166.84 137.37 3.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.846 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -109.68 130.66 55.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.904 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.2 p -144.64 175.35 10.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.839 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 55.9 m-70 -129.36 93.06 3.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.838 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.5 -34.56 72.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.906 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.28 164.99 13.52 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.677 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.61 -12.69 34.86 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.508 2.139 . . . . 0.0 112.81 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -149.91 65.38 0.98 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.953 0.406 . . . . 0.0 110.967 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -163.88 159.29 20.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.853 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -116.72 169.77 9.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.831 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.6 tp -170.01 94.91 0.26 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.031 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.536 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 39.2 t -99.49 69.65 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.897 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -89.52 172.89 8.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.057 0.456 . . . . 0.0 111.487 -179.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.402 ' HB2' ' CD1' ' A' ' 56' ' ' PHE . 22.0 tt0 -142.72 141.06 31.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.641 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 2.8 mm -84.79 147.91 5.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.357 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.402 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -122.28 87.81 2.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.616 179.522 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.8 mmtt -53.01 -23.87 8.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.388 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -47.18 -33.12 4.95 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.194 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -149.07 20.45 0.98 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.193 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.8 m120 47.29 67.8 0.74 Allowed 'General case' 0 C--O 1.231 0.106 0 CA-C-O 120.848 0.356 . . . . 0.0 111.261 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.402 ' HB ' ' CG ' ' A' ' 72' ' ' LYS . 16.0 m -133.96 150.82 51.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.05 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.1 tt -102.34 100.6 10.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.407 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 2.6 t80 -93.77 112.7 24.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.017 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.417 HD12 ' CE2' ' A' ' 10' ' ' PHE . 23.1 mt -67.39 175.18 2.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.712 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.536 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 73.2 t -149.39 -85.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.414 -179.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.7 mtt85 -99.0 162.51 13.03 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.917 0.389 . . . . 0.0 111.059 -179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 tt -176.5 127.48 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.87 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 154.87 -166.5 32.46 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.437 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.8 m -118.3 145.56 44.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.854 0.359 . . . . 0.0 110.903 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 13.2 p80 -62.22 -34.54 76.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.9 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.88 -34.08 77.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.909 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -79.61 -63.98 1.29 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.942 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.5 mp . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.829 -179.982 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.7 mp . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.788 0.328 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.96 -177.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.802 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.4 mp -132.14 107.36 12.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.167 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -105.28 167.63 9.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.654 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.8 p -135.87 157.65 46.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.172 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.438 ' HB3' ' CE1' ' A' ' 79' ' ' PHE . 59.8 p -113.86 -176.57 2.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.04 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.9 mmmt -71.16 -58.41 3.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.848 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 26.4 mttp -58.38 -30.36 66.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.876 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.415 ' CZ ' HD12 ' A' ' 80' ' ' LEU . 93.3 t80 -58.66 -33.72 70.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -66.71 -43.19 84.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.954 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.1 mttt -74.36 -20.12 60.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.237 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.47 -27.31 24.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.181 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.89 -36.74 19.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.117 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -58.51 -29.06 65.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.209 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.47 HD11 HG22 ' A' ' 16' ' ' ILE . 30.2 mm -81.46 -29.16 10.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.285 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 24.3 mt -82.11 -39.94 22.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.076 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.8 p -58.19 -30.44 39.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.163 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.86 -28.99 25.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.932 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -98.45 31.19 2.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.833 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.21 90.57 0.93 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.524 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.406 ' CZ ' HD13 ' A' ' 26' ' ' LEU . 11.1 t80 -175.43 93.76 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.821 0.343 . . . . 0.0 110.863 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -69.81 167.12 17.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.849 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -92.1 -31.01 15.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.962 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.83 -34.61 73.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.406 HD13 ' CZ ' ' A' ' 22' ' ' PHE . 3.9 pp -60.12 -35.51 75.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.938 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.75 -29.71 68.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.897 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -82.27 -28.83 31.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.956 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.2 -32.83 19.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.037 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.7 p -68.25 -21.33 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.418 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.0 p -48.43 -29.29 2.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.437 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.02 -29.35 72.4 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.458 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -89.99 -26.74 20.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.687 0.279 . . . . 0.0 110.956 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 65.8 mt -63.92 -42.77 97.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.943 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.75 -35.98 70.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.067 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.0 p -76.67 -46.61 24.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.89 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 59.34 48.84 9.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.919 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.417 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 2.1 mt-30 -90.27 -52.1 0.33 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.195 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.417 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 73.6 Cg_endo -83.36 -92.77 0.0 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.381 2.054 . . . . 0.0 112.823 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 53.82 28.95 8.96 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-O 120.801 0.334 . . . . 0.0 111.025 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 66.66 140.77 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.001 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.38 -40.65 2.93 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.511 2.141 . . . . 0.0 112.563 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.431 ' HG3' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -54.09 -42.06 68.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.114 -179.754 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.431 ' CE1' ' HG3' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -146.17 72.21 1.28 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.947 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.4 mttt -56.63 -79.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.984 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.1 t0 -178.4 140.28 0.2 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.752 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 16.9 p-80 -146.54 145.16 22.43 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo . . . . . 0 C--N 1.345 0.352 0 C-N-CA 122.499 2.133 . . . . 0.0 112.365 -179.959 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 . . . . . 0 C--O 1.23 0.041 0 CA-C-O 120.818 0.342 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -60.29 150.98 28.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.92 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 -161.91 142.91 10.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.742 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -125.82 140.31 52.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.145 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.6 p -144.31 160.29 41.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.804 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -108.31 82.19 1.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.985 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.9 pp -59.76 -33.24 71.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.823 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.427 ' CB ' ' HD2' ' A' ' 63' ' ' PRO . 1.0 OUTLIER -110.72 170.36 5.37 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.643 179.845 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.427 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 43.4 Cg_endo -68.43 -8.6 23.53 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.431 2.087 . . . . 0.0 112.893 -179.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -158.49 58.79 0.45 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.865 0.364 . . . . 0.0 111.038 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.4 mp -151.9 150.84 30.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.054 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -119.22 106.78 12.68 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.501 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 40.0 tp -96.28 97.26 9.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.95 0.405 . . . . 0.0 111.479 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.496 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 27.6 t -94.85 123.73 47.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.062 178.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.477 ' CD1' ' CD1' ' A' ' 71' ' ' ILE . 2.4 p90 -140.8 177.71 7.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.915 0.388 . . . . 0.0 111.285 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.83 106.49 4.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.643 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.477 ' CD1' ' CD1' ' A' ' 69' ' ' TYR . 1.5 mp -84.96 137.85 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.896 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.01 101.72 8.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.568 179.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.6 ptpp? -60.19 -20.72 59.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.279 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.65 -32.01 49.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.838 0.352 . . . . 0.0 111.025 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -145.21 17.14 1.54 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.273 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 21.2 m120 46.92 74.46 0.15 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.789 0.328 . . . . 0.0 111.336 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.6 m -134.08 139.48 45.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.925 0.393 . . . . 0.0 110.955 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.06 94.36 5.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.639 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.438 ' CE1' ' HB3' ' A' ' 7' ' ' SER . 3.4 t80 -92.2 112.88 24.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.986 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.415 HD12 ' CZ ' ' A' ' 10' ' ' PHE . 16.1 mt -71.66 171.07 12.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.707 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.496 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 92.7 t -147.65 -65.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.084 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -115.73 166.03 12.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.06 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -178.92 119.73 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.885 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.63 -168.53 26.3 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.449 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.1 t -100.32 172.59 7.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.852 0.358 . . . . 0.0 110.972 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -79.04 -40.46 31.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.857 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.7 m -74.26 -31.35 62.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.871 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.15 -31.86 70.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.85 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.1 mm? . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.785 179.972 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 mt . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.849 0.357 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.19 -175.47 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.763 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -132.04 118.13 35.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.073 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -111.79 168.65 9.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.896 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.6 p -143.45 148.41 36.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.999 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.422 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 6.9 p -109.81 -171.1 1.77 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.903 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm -79.78 -33.92 40.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.668 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -80.5 -26.45 38.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.934 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.429 ' CZ ' HD11 ' A' ' 80' ' ' LEU . 35.9 t80 -72.01 -30.63 65.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.934 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.12 -39.38 49.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.128 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.2 ptmm? -75.74 -13.14 60.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.421 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -90.11 -32.33 16.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.686 0.279 . . . . 0.0 111.056 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tp -79.48 -40.17 30.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.165 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -57.4 -23.28 48.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.234 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.9 mm -86.05 -29.86 6.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.172 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mt -85.96 -34.02 20.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.934 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.3 p -60.42 -34.91 59.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.1 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.03 -46.09 58.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.844 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -73.15 -30.9 63.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.928 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 146.91 84.91 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.41 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.426 ' CZ ' HD12 ' A' ' 26' ' ' LEU . 8.3 t80 -164.66 99.11 0.79 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.712 0.291 . . . . 0.0 110.882 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.73 166.22 11.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.843 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.3 mp -98.04 -29.99 12.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.859 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.7 -32.64 74.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.957 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.426 HD12 ' CZ ' ' A' ' 22' ' ' PHE . 4.0 pp -59.6 -31.69 69.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.855 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.97 -26.66 66.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.066 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 32.3 m-85 -79.76 -26.83 40.57 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.058 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.72 -29.64 19.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.16 -179.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.8 p -74.25 -25.56 19.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.213 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.6 p -49.03 -29.36 2.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.333 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -67.57 -29.11 73.68 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.342 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -89.99 -32.77 16.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.911 0.386 . . . . 0.0 110.958 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 40.6 mt -68.08 -41.64 81.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.833 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.07 -40.02 94.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.118 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 68.3 p -75.67 -36.68 60.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.876 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 59.8 52.54 5.36 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.863 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -96.42 -52.82 0.22 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.595 -179.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -81.78 -82.57 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.383 2.055 . . . . 0.0 113.238 -179.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 48.69 40.72 16.43 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.895 0.378 . . . . 0.0 111.136 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.69 132.66 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.085 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -74.24 -25.26 13.72 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.497 2.131 . . . . 0.0 112.451 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.31 -28.34 38.23 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.071 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.41 ' HB3' ' CD2' ' A' ' 60' ' ' HIS . 14.6 m-85 -103.19 -61.5 1.4 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.026 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.9 140.38 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.839 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -59.7 151.17 25.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.909 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -162.76 146.65 8.97 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo . . . . . 0 C--N 1.346 0.402 0 C-N-CA 122.462 2.108 . . . . 0.0 112.366 179.97 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.827 0.346 . . . . 0.0 110.973 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -66.0 176.01 1.83 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.009 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -177.41 130.57 0.16 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.65 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -103.23 137.98 40.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.985 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 15.1 m -141.97 -176.29 4.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.83 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.41 ' CD2' ' HB3' ' A' ' 44' ' ' TYR . 23.4 m-70 -143.26 93.76 2.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.914 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.66 -29.55 65.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.902 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -121.69 162.77 34.83 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.809 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.69 -12.76 32.94 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.602 2.202 . . . . 0.0 112.772 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -148.75 65.7 1.05 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.83 0.348 . . . . 0.0 111.254 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -163.25 149.61 12.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.025 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -115.86 149.01 39.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.633 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -149.66 93.32 2.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.131 -179.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.506 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 38.7 t -95.37 69.4 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.968 0.413 . . . . 0.0 110.794 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.424 ' CE1' HD12 ' A' ' 71' ' ' ILE . 9.9 p90 -89.64 168.64 11.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.457 -179.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -137.64 141.13 41.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.692 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.436 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.4 mp -108.79 119.67 58.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.792 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.23 99.21 11.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.655 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.3 mttp -60.73 -28.1 68.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.359 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -52.87 -28.36 22.7 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.836 0.351 . . . . 0.0 111.149 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -139.7 10.94 2.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.558 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 46.82 76.14 0.11 Allowed 'General case' 0 N--CA 1.461 0.1 0 CA-C-O 120.838 0.351 . . . . 0.0 111.335 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 54.8 m -139.85 150.21 44.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.933 0.397 . . . . 0.0 111.036 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.0 tp -107.14 93.84 4.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.434 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.422 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 4.3 t80 -89.87 107.33 19.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.841 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.429 HD11 ' CZ ' ' A' ' 10' ' ' PHE . 1.9 mt -71.36 173.93 7.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.96 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.506 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 90.5 t -151.92 -84.55 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.203 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 34.8 ttt180 -83.42 163.28 20.65 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.949 0.404 . . . . 0.0 110.771 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.421 HD12 ' CE2' ' A' ' 22' ' ' PHE . 1.3 tm? -175.49 95.12 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.889 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 144.25 -168.67 26.56 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.622 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.9 t -112.96 159.41 19.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.756 0.312 . . . . 0.0 110.97 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -62.43 -39.34 93.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.909 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 23.6 m -71.4 -33.22 69.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.921 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.33 -48.12 65.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.884 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.023 179.942 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.8 mmt . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 120.936 0.398 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.65 130.83 44.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.922 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.53 -174.5 0.55 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.872 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -130.27 114.66 29.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.992 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.65 164.49 11.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.795 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 32.7 p -134.76 151.3 50.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.943 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.414 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 8.1 t -105.29 -169.52 1.61 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.07 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.0 mtmt -81.59 -56.44 4.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.887 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.2 mtmt -58.85 -30.76 67.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.825 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -63.62 -46.52 85.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.777 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -58.73 -30.8 67.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.963 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.13 -6.04 59.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.55 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.96 -49.67 6.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.817 0.341 . . . . 0.0 111.194 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.416 HD12 ' CE2' ' A' ' 22' ' ' PHE . 1.3 tp -59.43 -38.3 80.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.338 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.2 ptpp? -56.96 -26.46 59.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.316 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 29.1 mm -85.19 -28.56 6.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.375 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.1 mt -86.29 -32.47 21.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.138 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 p -64.49 -31.59 54.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.06 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.14 -40.2 38.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.932 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -77.64 -39.01 46.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.943 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 156.89 89.4 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.479 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.416 ' CE2' HD12 ' A' ' 14' ' ' LEU . 18.1 t80 -154.56 168.1 27.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.819 0.342 . . . . 0.0 110.876 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -122.01 155.31 35.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.946 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.4 mp -83.77 -50.86 7.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.982 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.2 ttmm -65.02 -21.05 66.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.123 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -52.85 -43.06 65.78 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.079 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.4 ' HA ' HG13 ' A' ' 30' ' ' VAL . 5.8 tp -64.23 -54.24 36.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.866 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -62.96 -18.27 62.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.953 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -90.07 -36.99 14.57 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.185 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.4 HG13 ' HA ' ' A' ' 27' ' ' LEU . 9.5 p -71.8 -20.99 20.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.451 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.5 p -49.35 -40.52 14.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.368 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.91 -28.62 66.29 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.354 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -89.98 -22.62 21.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.791 0.329 . . . . 0.0 111.096 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.5 mt -74.5 -35.86 63.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.854 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.05 -31.33 62.83 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.282 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 65.9 p -94.43 -34.7 12.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.937 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 60.1 62.17 1.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.739 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.55 -51.68 0.23 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.857 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -80.49 -80.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.337 2.025 . . . . 0.0 113.349 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.0 mm? 46.67 27.95 0.73 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.633 0.254 . . . . 0.0 111.432 -179.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.409 ' CB ' ' HB2' ' A' ' 44' ' ' TYR . . . 59.54 117.25 0.02 OUTLIER Pre-proline 0 CA--C 1.53 0.193 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.232 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -52.99 -41.92 68.09 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.461 2.107 . . . . 0.0 112.589 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.12 -26.76 60.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.32 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.409 ' HB2' ' CB ' ' A' ' 41' ' ' ALA . 3.5 m-85 -87.85 -66.42 0.92 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.839 0.352 . . . . 0.0 110.988 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.01 117.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.2 p-10 -56.1 157.25 4.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.061 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -162.01 155.18 17.42 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.949 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.91 -176.49 1.83 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.528 2.152 . . . . 0.0 112.286 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -114.31 -48.98 2.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.979 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.2 mttp 61.45 169.65 0.11 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.803 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 98.88 47.29 1.94 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.4 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 96.75 -30.15 9.36 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.508 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.425 ' HB3' ' CD2' ' A' ' 56' ' ' PHE . 1.8 mt -118.41 87.01 2.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.864 0.364 . . . . 0.0 110.798 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.0 ptpt -76.44 -25.24 54.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.148 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 56' ' ' PHE . 4.0 m-20 -84.34 54.75 3.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.888 0.375 . . . . 0.0 110.908 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.425 ' CD2' ' HB3' ' A' ' 53' ' ' LEU . 67.8 m-85 -157.05 122.88 4.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.851 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -143.41 139.89 30.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.719 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -121.51 143.09 49.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.987 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.8 p -131.28 -174.33 3.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.693 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 34.8 m-70 -143.14 90.49 2.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.987 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.1 pp -59.64 -41.28 90.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.721 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.61 166.05 12.94 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.832 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.0 -11.86 32.9 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.561 2.174 . . . . 0.0 112.594 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -145.57 48.18 1.26 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.8 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -156.68 132.19 9.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.168 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.03 177.81 5.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.247 179.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.414 HD21 ' CD1' ' A' ' 69' ' ' TYR . 5.7 tt -166.37 99.11 0.6 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.899 0.38 . . . . 0.0 111.403 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.4 t -90.0 136.41 23.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.115 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.414 ' CD1' HD21 ' A' ' 67' ' ' LEU . 7.3 p90 -153.03 169.69 22.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.925 0.393 . . . . 0.0 111.447 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -140.01 123.58 17.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.68 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 2.9 mm -84.82 150.28 4.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.329 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.48 87.06 2.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.76 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -21.14 43.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.213 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -50.85 -31.34 16.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.753 0.311 . . . . 0.0 111.021 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -144.0 17.48 1.76 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.201 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 47.99 71.91 0.31 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.809 0.337 . . . . 0.0 111.286 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 55.4 m -138.21 145.77 41.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.022 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.2 95.15 5.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.669 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.414 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.1 t80 -92.16 115.68 28.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.014 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.406 ' O ' ' CE1' ' A' ' 79' ' ' PHE . 20.0 mt -76.19 168.3 20.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.673 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 48.0 t -131.85 -68.94 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.086 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -128.16 167.06 17.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.951 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 9.7 tt -171.9 134.75 0.79 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.834 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.28 -149.51 21.44 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.581 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.8 150.08 48.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.818 0.342 . . . . 0.0 110.804 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -59.99 -43.36 95.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.824 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.7 p -70.82 -32.96 70.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.92 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.49 -56.59 6.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.861 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.0 mp -60.85 -38.96 87.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.856 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.134 -0.936 . . . . 0.0 110.884 -179.914 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 mtm . . . . . 0 N--CA 1.488 1.427 0 CA-C-O 120.791 0.329 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.4 mt -135.56 147.44 48.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.76 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.13 -176.47 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.829 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -128.5 113.93 31.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.171 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -114.29 165.83 12.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.763 179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 63.0 p -132.57 162.42 31.33 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.023 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.411 ' HB3' ' CE1' ' A' ' 79' ' ' PHE . 1.0 OUTLIER -118.64 -176.53 3.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.918 -179.948 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.68 -47.36 32.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.856 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.9 mttt -67.52 -34.56 77.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.857 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -63.22 -31.22 72.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -69.29 -53.38 20.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.91 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -13.33 61.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.318 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -82.15 -29.2 31.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.774 0.321 . . . . 0.0 110.998 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.58 -31.71 63.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.983 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -26.48 68.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.058 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.1 mm -81.48 -29.74 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.21 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -84.51 -36.25 22.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.081 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.81 -33.75 63.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.133 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.7 tptt -71.23 -36.35 71.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -87.6 -24.25 24.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.961 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 138.3 94.69 0.32 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.354 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.427 ' CZ ' HD12 ' A' ' 26' ' ' LEU . 50.5 t80 -167.64 125.56 1.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.82 0.343 . . . . 0.0 110.988 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.95 -176.44 3.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.7 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -111.73 -32.14 6.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.95 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.57 -29.87 68.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.957 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.427 HD12 ' CZ ' ' A' ' 22' ' ' PHE . 4.2 pp -72.9 -31.33 64.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.992 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.67 -26.48 61.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.023 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -86.3 -29.31 23.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.897 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.19 -32.53 19.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.969 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.6 p -62.21 -18.56 20.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.267 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.6 p -50.97 -43.41 25.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.755 0.312 . . . . 0.0 111.26 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.19 -28.12 63.71 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.355 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.7 m-20 -89.96 -24.26 21.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.796 0.331 . . . . 0.0 111.006 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 68.4 mt -72.51 -34.01 67.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.942 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.96 -39.06 30.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.232 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.0 p -83.88 -38.99 20.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.886 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 59.71 66.69 0.96 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.925 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -94.56 -53.11 0.24 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.16 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -85.82 -88.97 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.611 2.207 . . . . 0.0 112.81 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 59.32 21.25 9.49 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.67 0.272 . . . . 0.0 111.038 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.31 128.73 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.002 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.17 -23.55 21.08 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.426 2.084 . . . . 0.0 112.476 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.35 -30.63 42.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.069 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.41 ' HB3' ' CD2' ' A' ' 60' ' ' HIS . 59.2 m-85 -101.56 -58.04 1.96 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.077 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.7 mttt 62.52 149.64 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.883 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -92.13 161.47 14.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.87 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -159.25 158.73 28.64 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.914 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -74.38 -4.14 14.94 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.654 2.236 . . . . 0.0 112.787 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 75.03 -60.23 0.52 Allowed 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.785 0.326 . . . . 0.0 110.988 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.8 mttm 64.76 173.25 0.2 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.871 0.367 . . . . 0.0 110.918 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 96.35 36.28 5.2 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.312 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.81 -30.64 9.7 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.49 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 11.2 mt -119.9 68.84 0.84 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.877 0.37 . . . . 0.0 110.829 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -67.96 -31.15 70.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.862 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.78 -34.16 77.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.833 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -84.86 138.79 32.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.868 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -156.73 155.21 31.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.887 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -130.15 133.87 46.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.972 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 28.9 p -119.09 -172.04 2.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.798 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.41 ' CD2' ' HB3' ' A' ' 44' ' ' TYR . 68.7 m-70 -140.5 79.9 1.73 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.887 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.1 pp -55.91 -50.63 70.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.866 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.7 mttt -95.15 167.69 12.43 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.705 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.66 -12.78 37.25 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.545 2.163 . . . . 0.0 112.604 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -150.92 51.74 0.86 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.677 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -156.5 130.47 8.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.065 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.21 160.92 14.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.295 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.429 HD22 ' CD1' ' A' ' 69' ' ' TYR . 5.1 tt -148.78 102.62 3.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.854 0.359 . . . . 0.0 111.344 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.41 ' O ' ' N ' ' A' ' 81' ' ' VAL . 25.7 t -90.01 128.78 41.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.231 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.429 ' CD1' HD22 ' A' ' 67' ' ' LEU . 12.1 p90 -150.08 165.94 31.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.909 0.385 . . . . 0.0 111.13 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -145.95 124.38 12.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.858 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.438 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.5 mp -90.39 151.85 3.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.893 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.404 ' HB2' ' CG ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -120.62 104.0 9.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.733 179.758 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.76 -24.53 64.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.374 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.404 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 1.5 pt20 -53.22 -33.9 54.81 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.089 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -142.95 15.5 1.92 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.444 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 46.12 74.32 0.15 Allowed 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.78 0.324 . . . . 0.0 111.332 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.8 m -136.08 140.34 43.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.933 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.82 90.51 5.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.686 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.411 ' CE1' ' HB3' ' A' ' 7' ' ' SER . 2.9 t80 -90.0 106.94 18.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.916 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.4 mt -64.53 169.46 4.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.767 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.41 ' N ' ' O ' ' A' ' 68' ' ' VAL . 42.5 t -131.86 -69.81 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.174 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.8 mmm-85 -132.98 178.57 6.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.847 0.356 . . . . 0.0 111.101 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.7 tt -177.89 144.34 0.35 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.93 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 139.72 -131.72 5.28 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.576 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 39.3 t -147.98 147.12 29.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.769 0.319 . . . . 0.0 110.938 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -59.69 -30.95 69.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.838 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.2 m -78.87 -37.04 41.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.87 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -68.52 -55.43 11.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.854 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.3 mp -63.84 -72.3 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.862 179.934 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.5 ttm . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.871 0.367 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.0 131.86 44.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.838 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.73 -177.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.039 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.9 mp -131.64 130.43 62.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.055 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -121.57 165.94 14.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.803 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 43.1 p -127.43 160.14 32.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.026 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.42 ' HB3' ' CE1' ' A' ' 79' ' ' PHE . 0.5 OUTLIER -117.32 -176.37 2.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.912 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 ptpt -76.78 -47.14 22.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.857 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.7 mtpt -67.96 -31.18 70.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.775 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.408 ' CE1' HD23 ' A' ' 14' ' ' LEU . 56.2 t80 -59.65 -39.36 84.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.87 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.85 -34.51 78.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.939 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 mttm -78.54 -24.73 45.5 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.158 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -87.72 -28.58 21.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.109 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.408 HD23 ' CE1' ' A' ' 10' ' ' PHE . 0.1 OUTLIER -80.37 -28.41 38.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.14 -179.832 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 11.8 pttt -70.83 -28.53 64.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.267 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 28.4 mm -83.21 -45.17 18.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.312 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.4 mt -63.07 -40.35 97.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.012 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 p -64.27 -29.85 48.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.106 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -77.33 -37.51 52.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.903 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -82.24 -49.25 10.3 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.899 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 170.26 89.44 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.486 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -174.34 151.69 1.65 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.859 0.362 . . . . 0.0 110.856 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -126.7 159.2 34.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.908 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -89.46 -29.42 19.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.005 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -58.31 -41.49 84.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.896 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.9 pp -66.45 -31.34 72.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.861 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.3 tt -66.77 -28.37 68.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.041 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -78.84 -30.05 45.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.939 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -84.28 -35.58 23.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.065 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.6 p -69.63 -11.95 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.499 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.7 p -50.83 -41.57 21.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.858 0.361 . . . . 0.0 111.261 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.68 -28.37 72.23 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.297 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -84.66 -19.91 32.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.715 0.293 . . . . 0.0 111.21 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.3 mt -70.88 -45.38 64.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.798 0.332 . . . . 0.0 110.956 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.22 -50.17 66.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.242 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.8 p -75.26 -37.05 61.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.928 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 61.09 54.69 3.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.903 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.443 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 3.5 mt-30 -79.42 -52.59 1.13 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.31 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.443 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 56.0 Cg_endo -73.09 -88.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.065 1.843 . . . . 0.0 112.544 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.0 mp 51.95 -178.49 0.02 OUTLIER 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.758 0.313 . . . . 0.0 111.077 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.423 ' HB1' ' CD2' ' A' ' 44' ' ' TYR . . . -122.17 114.74 30.54 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.161 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.13 71.1 2.27 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.5 2.133 . . . . 0.0 112.299 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.75 -41.0 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.959 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.423 ' CD2' ' HB1' ' A' ' 41' ' ' ALA . 16.2 m-85 -85.54 5.47 31.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.42 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp 62.52 145.98 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.888 0.375 . . . . 0.0 110.978 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -156.04 109.3 2.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.874 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.42 ' CG ' ' HD2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -169.8 167.01 5.31 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.744 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 47' ' ' HIS . 43.1 Cg_endo -68.11 -176.11 0.97 Allowed 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.514 2.143 . . . . 0.0 112.306 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.8 mt -127.13 -176.02 3.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.868 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -150.97 177.5 10.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.929 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.2 55.39 3.75 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.503 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 95.08 -20.47 49.05 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.678 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.1 mt -119.55 92.27 3.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.798 0.332 . . . . 0.0 110.989 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.4 mtpp -97.1 -45.46 6.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.884 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -69.79 -22.96 63.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.155 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -69.28 133.09 47.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.009 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 21.4 mtp180 -150.75 150.83 31.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.743 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -139.17 120.87 15.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.883 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.1 p -127.82 150.78 49.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.875 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.412 ' CE1' ' HB3' ' A' ' 44' ' ' TYR . 10.8 m-70 -102.44 78.43 1.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.999 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.2 pp -58.99 -33.25 70.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.974 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.1 mmmm -127.61 159.66 64.78 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.713 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.54 122.71 12.12 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.649 2.232 . . . . 0.0 112.273 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 61.7 39.85 13.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.971 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -138.36 104.04 5.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.914 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -95.72 123.28 39.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.554 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.9 tt -117.82 99.51 6.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.945 0.402 . . . . 0.0 111.168 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.406 ' O ' ' N ' ' A' ' 81' ' ' VAL . 16.3 t -89.79 138.68 18.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.081 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -147.09 -178.07 6.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.086 0.469 . . . . 0.0 111.57 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -162.1 111.45 1.49 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.574 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.422 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.5 mp -84.7 146.62 6.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.058 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.06 103.95 11.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.742 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.08 -22.21 26.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.328 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -47.49 -36.65 10.54 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.289 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -148.26 21.03 1.08 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.268 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 26.4 m-20 48.27 71.92 0.31 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.914 0.387 . . . . 0.0 111.117 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 99.7 m -128.71 147.54 50.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.911 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -102.5 92.63 4.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.727 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.42 ' CE1' ' HB3' ' A' ' 7' ' ' SER . 2.1 t80 -91.19 102.7 15.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.872 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.65 167.21 6.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.716 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.406 ' N ' ' O ' ' A' ' 68' ' ' VAL . 59.3 t -137.92 -66.62 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.971 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.39 163.34 15.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.974 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -176.38 91.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.826 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 172.53 -152.29 16.31 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.667 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.3 t -127.0 141.71 51.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.856 0.36 . . . . 0.0 110.805 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -59.39 -30.16 68.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.891 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.15 -31.47 30.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.906 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -69.12 -48.86 61.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.923 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.6 mp -59.24 -31.2 68.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.882 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.307 -0.854 . . . . 0.0 110.848 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.844 0.354 . . . . 0.0 111.099 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.6 mp -145.12 146.06 31.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.823 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.45 -177.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.836 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.9 mp -128.76 123.01 58.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.039 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -121.05 166.02 14.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.79 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 41.3 p -134.4 150.72 50.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.985 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.426 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 2.6 t -105.49 178.32 4.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.005 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.21 -47.11 65.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.807 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -68.46 -31.94 71.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.742 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.419 ' CZ ' HD11 ' A' ' 80' ' ' LEU . 85.2 t80 -64.02 -41.84 97.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.892 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -60.3 -52.71 64.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.935 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.2 ptmt -69.71 -12.41 61.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.26 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -90.05 -24.22 21.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.247 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.2 tp -89.97 -44.68 9.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.384 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.51 -24.64 13.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.413 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 29.4 mm -80.67 -28.88 11.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.223 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 25.3 mt -87.06 -38.4 16.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.071 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.1 p -59.05 -40.32 80.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.04 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -30.0 69.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.836 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -100.64 28.26 5.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.888 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.68 102.79 0.55 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.673 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.419 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 53.5 t80 -175.67 -40.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.713 0.292 . . . . 0.0 110.878 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 59.41 173.9 0.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.912 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -117.86 17.05 14.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.081 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.02 -33.54 16.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.875 0.369 . . . . 0.0 110.871 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.419 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 4.3 pp -64.66 -29.62 70.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.977 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.411 ' HA ' ' CG1' ' A' ' 30' ' ' VAL . 3.3 tp -71.75 -36.36 70.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.903 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -76.47 -27.65 56.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.874 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.84 -31.57 20.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.986 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.411 ' CG1' ' HA ' ' A' ' 27' ' ' LEU . 14.7 p -78.36 -5.0 7.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.614 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.0 m -53.03 -42.91 46.41 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-O 120.89 0.376 . . . . 0.0 111.361 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.85 -26.98 70.52 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.432 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.2 m-20 -85.61 -22.4 28.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.632 0.253 . . . . 0.0 111.129 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 75.2 mt -76.54 -48.64 18.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.902 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.09 -36.02 82.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.213 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.5 p -88.16 -42.69 12.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.985 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 61.88 57.29 2.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.876 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.406 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 0.2 OUTLIER -88.72 -51.89 0.38 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.412 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.406 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 74.2 Cg_endo -79.95 -92.93 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.221 1.947 . . . . 0.0 112.703 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 55.86 -178.24 0.04 OUTLIER 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.826 0.346 . . . . 0.0 111.074 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.424 ' HB1' ' CD2' ' A' ' 44' ' ' TYR . . . -128.32 106.46 19.47 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.04 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.97 -7.14 20.76 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.425 2.083 . . . . 0.0 112.793 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.2 32.0 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.697 0.284 . . . . 0.0 111.013 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.424 ' CD2' ' HB1' ' A' ' 41' ' ' ALA . 18.1 m-85 -139.95 -79.66 0.3 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.932 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -177.98 37.67 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.922 0.391 . . . . 0.0 110.893 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.405 ' O ' ' CG ' ' A' ' 47' ' ' HIS . 43.3 p-10 -71.99 75.14 0.92 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.876 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.405 ' CG ' ' O ' ' A' ' 46' ' ' ASP . 1.4 m-70 -178.16 170.0 0.89 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.905 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -52.33 -176.04 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.599 2.199 . . . . 0.0 112.231 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.6 mp -109.02 -75.12 0.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.944 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.9 mtmt 174.01 -172.95 0.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.903 0.382 . . . . 0.0 110.744 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 87.16 -149.23 21.93 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.457 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.27 30.91 3.1 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.54 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.3 mp -93.52 -46.51 7.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.836 0.351 . . . . 0.0 110.887 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.87 29.37 18.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.888 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.91 -41.52 2.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.72 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -80.61 129.32 34.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.855 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -148.22 133.31 18.26 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.728 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -109.76 146.37 35.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.97 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 21.2 m -149.69 141.95 24.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.772 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.405 ' CE1' HD23 ' A' ' 66' ' ' LEU . 10.0 m-70 -101.97 92.72 4.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.008 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.0 pp -62.2 -39.88 94.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.755 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -104.53 169.14 7.54 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.741 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -71.1 -7.91 22.41 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.559 2.172 . . . . 0.0 112.95 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -150.6 45.01 0.86 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.864 0.364 . . . . 0.0 111.156 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.3 mp -158.91 130.21 6.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.152 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.405 HD23 ' CE1' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -94.24 -179.41 4.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.28 179.532 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.4 tt -170.09 102.24 0.29 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.836 0.35 . . . . 0.0 111.383 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.415 ' O ' ' N ' ' A' ' 81' ' ' VAL . 22.8 t -95.23 137.33 23.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.444 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -147.05 170.55 16.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.982 0.42 . . . . 0.0 111.405 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -143.03 114.2 7.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.553 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.441 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.4 mp -84.89 135.52 24.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.933 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.98 103.79 12.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.85 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.77 -19.85 62.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.153 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -51.65 -36.51 46.45 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.861 0.362 . . . . 0.0 111.042 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -144.99 18.56 1.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.193 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.8 m120 47.27 77.24 0.09 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.829 0.347 . . . . 0.0 111.188 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 63.7 m -137.39 144.04 42.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.102 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 38.1 tp -98.61 91.09 4.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.451 179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.426 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.1 t80 -89.8 105.82 18.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.888 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.419 HD11 ' CZ ' ' A' ' 10' ' ' PHE . 3.0 mt -64.75 169.26 5.22 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.774 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.415 ' N ' ' O ' ' A' ' 68' ' ' VAL . 74.7 t -136.8 -71.48 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.086 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -118.67 168.44 10.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.932 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.5 tt -176.61 117.37 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.923 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 158.14 -147.86 16.32 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.497 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.8 136.89 29.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.821 0.343 . . . . 0.0 110.917 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.38 -30.4 66.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.909 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.7 p -76.75 -30.77 56.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.859 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -80.27 -54.84 5.36 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.927 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.5 mp -60.09 -64.92 0.78 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.772 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.821 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.791 0.329 . . . . 0.0 111.115 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.5 mp -131.91 158.06 42.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.926 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.76 -173.41 0.46 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.792 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.0 mp -130.2 136.76 57.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.075 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -139.63 161.09 38.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.753 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.6 p -135.36 155.43 50.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.082 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.41 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 8.7 p -110.89 -168.7 1.34 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.795 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -81.14 -42.47 20.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.942 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 71.0 mttt -72.25 -41.05 67.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.892 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.407 ' CE1' HD22 ' A' ' 14' ' ' LEU . 14.2 t80 -59.86 -34.39 73.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.805 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -65.61 -31.12 71.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.6 mtpp -87.36 -8.04 57.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.389 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -88.98 -29.48 19.48 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.792 0.329 . . . . 0.0 111.128 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.407 HD22 ' CE1' ' A' ' 10' ' ' PHE . 21.9 mt -84.08 -35.3 23.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.076 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 27.7 pttt -58.7 -29.85 66.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.172 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.426 HG22 HD12 ' A' ' 16' ' ' ILE . 29.3 mm -79.89 -39.16 19.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.282 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.6 mp -72.31 -41.04 67.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.014 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.6 p -63.74 -30.14 49.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.232 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -76.55 -33.9 58.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.824 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -83.15 -59.27 2.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.765 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -170.07 63.11 0.17 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.378 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.421 ' CZ ' HD13 ' A' ' 26' ' ' LEU . 1.3 t80 -151.21 172.09 16.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.81 0.338 . . . . 0.0 110.89 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -151.42 144.1 24.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.826 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.0 mp -71.25 -23.78 62.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.043 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -51.73 68.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.073 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.421 HD13 ' CZ ' ' A' ' 22' ' ' PHE . 2.4 pp -58.75 -31.75 68.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.007 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.24 -31.24 72.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.894 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -80.72 -26.65 37.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.7 mtpp -87.57 -29.41 21.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.973 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.8 p -76.12 -16.88 15.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.471 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.8 t -48.39 -42.06 11.6 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 120.83 0.348 . . . . 0.0 111.356 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.83 -27.5 64.39 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.339 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.9 m-20 -85.32 -22.44 28.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.819 0.343 . . . . 0.0 111.039 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.6 mt -74.26 -33.4 63.28 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.85 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.88 -43.27 62.72 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.087 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 73.3 p -86.26 -39.29 16.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.87 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 60.85 67.96 0.78 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.846 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.406 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -92.93 -53.57 0.26 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.255 -179.74 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.406 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 57.6 Cg_endo -82.82 -86.58 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 122.287 1.991 . . . . 0.0 112.545 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.8 mp 55.38 39.44 31.2 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.786 0.327 . . . . 0.0 111.148 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 60.54 100.31 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.206 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.35 62.24 2.73 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.465 2.11 . . . . 0.0 112.404 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.12 -44.6 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.967 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -82.33 -29.68 30.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.9 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.3 mmpp? 62.08 118.7 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.032 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -81.94 154.73 25.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.716 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 12.3 p80 177.09 156.72 0.46 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.869 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.05 159.09 45.04 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.621 2.214 . . . . 0.0 112.419 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.2 mt -65.26 -67.22 0.46 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.848 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.8 mttm -146.12 104.34 3.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.95 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -65.91 123.6 24.48 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.515 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 111.9 33.16 2.26 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.584 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -177.76 -39.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.815 0.341 . . . . 0.0 110.981 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -134.45 138.0 44.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.92 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -98.39 28.47 4.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.999 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -80.72 174.42 11.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.827 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -175.53 125.73 0.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.837 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -116.03 130.56 56.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.782 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 28.5 p -134.3 -175.68 3.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.971 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 85.8 m-70 -134.67 80.37 1.85 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.014 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.3 pp -57.34 -31.24 65.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.122 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -135.6 151.63 74.78 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.984 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -51.81 133.31 44.84 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.522 2.148 . . . . 0.0 112.34 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 59.41 25.55 14.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.011 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.3 mp -134.35 117.28 16.19 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.787 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.03 179.35 5.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.717 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 37.8 tp -167.39 100.35 0.51 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.372 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' A' ' 81' ' ' VAL . 41.4 t -95.3 123.33 47.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.893 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 10.3 p90 -138.78 159.5 41.97 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.976 0.417 . . . . 0.0 111.463 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -136.96 118.28 14.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.519 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.425 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.4 mp -84.94 123.63 39.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.921 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.03 100.52 12.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.699 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.89 -22.62 38.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.112 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -49.57 -36.06 22.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.844 0.354 . . . . 0.0 111.049 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -145.39 18.29 1.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.257 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 47.23 71.01 0.35 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.804 0.335 . . . . 0.0 111.217 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 97.6 m -130.19 148.68 52.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.065 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 65.0 tp -102.13 90.5 3.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.541 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.412 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 3.5 t80 -89.93 115.77 27.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.017 -179.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.412 ' O ' ' CE1' ' A' ' 79' ' ' PHE . 3.3 mm? -68.97 168.14 14.35 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.706 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.425 ' N ' ' O ' ' A' ' 68' ' ' VAL . 43.9 t -141.0 -58.75 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.98 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 41.5 mmm-85 -131.54 165.49 23.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.842 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.9 tt -177.05 139.1 0.26 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.948 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 118.85 -143.35 17.39 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.59 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.9 t -127.4 147.74 50.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.806 0.336 . . . . 0.0 110.861 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -59.3 -30.78 68.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.915 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.3 m -87.22 -31.52 20.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -67.7 -31.4 71.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.9 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.12 -64.16 1.05 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.226 -0.892 . . . . 0.0 110.866 179.999 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.905 0.383 . . . . 0.0 111.223 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.87 141.51 51.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.008 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.81 -170.45 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.863 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.0 mp -130.97 136.22 58.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.89 0.376 . . . . 0.0 111.187 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -128.31 170.05 13.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.644 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.6 p -137.68 165.66 25.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.854 0.359 . . . . 0.0 111.075 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.3 -175.3 3.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.913 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.13 -53.08 13.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.964 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -62.41 -36.29 81.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.913 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -59.56 -33.17 71.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.93 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -70.57 -40.6 73.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.849 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.1 mttt -78.31 -4.94 50.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.337 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -90.08 -56.54 3.18 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.829 0.347 . . . . 0.0 111.173 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -54.67 -36.8 65.0 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.224 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.8 ptpt -58.9 -30.29 67.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.998 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.1 mm -82.58 -30.48 9.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.249 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 69.5 mt -81.78 -39.5 24.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.949 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.7 p -59.74 -33.47 52.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.08 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.1 tttp -78.88 -30.06 44.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.991 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -98.33 29.07 3.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.93 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.09 95.42 0.89 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.603 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -176.66 101.52 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.837 0.351 . . . . 0.0 110.956 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -60.2 -167.87 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.863 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -118.7 -39.92 2.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.997 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.3 mttp -66.67 -27.06 67.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.181 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.4 ' CD1' ' N ' ' A' ' 27' ' ' LEU . 3.9 pp -57.92 -41.85 83.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.045 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.4 ' N ' ' CD1' ' A' ' 26' ' ' LEU . 2.8 tp -64.46 -30.05 71.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.038 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -73.37 -27.63 61.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.144 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.86 -30.63 18.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.054 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 34.8 t -75.01 -18.06 16.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.384 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 28.1 m -49.47 -27.97 3.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.828 0.347 . . . . 0.0 111.441 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -72.34 -27.39 69.92 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.606 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -86.97 -28.53 22.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.759 0.314 . . . . 0.0 111.077 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.3 mt -65.11 -44.61 88.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.981 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.84 -35.96 67.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.32 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 78.0 p -77.24 -45.12 27.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.887 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 60.81 55.97 3.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.794 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.409 ' N ' ' CD ' ' A' ' 39' ' ' PRO . 0.1 OUTLIER -91.72 -52.22 0.29 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.097 -179.799 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.409 ' CD ' ' N ' ' A' ' 38' ' ' GLN . 47.2 Cg_endo -83.48 -78.31 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.422 2.081 . . . . 0.0 112.736 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 57.7 24.75 10.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.728 0.299 . . . . 0.0 111.01 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.24 138.52 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.096 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.71 -20.88 15.1 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.583 2.189 . . . . 0.0 112.538 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.42 ' HG2' ' CD2' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -97.67 31.58 2.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.11 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.42 ' CD2' ' HG2' ' A' ' 43' ' ' LYS . 72.5 m-85 -157.92 -70.88 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.066 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 5.9 mmmt 63.55 139.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.933 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -73.58 161.94 29.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.939 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -165.08 154.26 11.23 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.867 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.17 160.07 43.83 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.57 2.18 . . . . 0.0 112.324 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.59 -58.86 1.9 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.836 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.8 mtmt -128.87 157.32 41.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.972 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -95.67 122.9 7.46 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.45 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 135.81 -29.15 2.89 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.453 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -131.91 -47.26 0.94 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.806 0.336 . . . . 0.0 110.871 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.7 mttt 58.17 30.38 19.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.912 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.18 -47.94 22.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.842 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -87.68 147.92 25.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.765 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -160.79 147.0 14.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.95 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.0 tt0 -127.48 117.63 22.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.933 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 30.3 p -115.02 177.48 4.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.843 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -124.05 90.05 3.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.893 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.8 pp -65.82 -32.43 73.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.883 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.4 mttp -139.16 165.18 33.89 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.809 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -62.01 130.58 31.38 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.54 2.16 . . . . 0.0 112.153 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 61.14 31.03 19.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.839 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -140.14 118.16 11.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.812 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -97.6 177.64 5.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.616 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.9 tt -165.37 102.35 0.73 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.12 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.409 ' O ' ' N ' ' A' ' 81' ' ' VAL . 37.5 t -94.65 124.16 47.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.167 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 5.6 p90 -141.18 157.94 44.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.933 0.397 . . . . 0.0 111.244 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -137.26 114.04 10.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.75 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.449 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.3 mp -84.98 131.99 32.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.88 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.417 ' HB2' ' CG ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -106.55 102.42 11.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.801 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.1 mttp -59.33 -23.43 62.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.491 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.417 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 1.1 pt20 -51.26 -33.49 28.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.73 0.3 . . . . 0.0 111.141 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -145.51 17.2 1.49 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.482 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 m120 46.53 72.61 0.22 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.894 0.378 . . . . 0.0 111.256 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.1 m -131.18 142.93 50.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.921 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 64.4 tp -97.06 90.29 5.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.525 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -91.68 106.35 18.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.899 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.43 -177.57 0.43 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.675 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.409 ' N ' ' O ' ' A' ' 68' ' ' VAL . 45.6 t -153.25 -62.99 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.165 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -127.54 166.49 17.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.868 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 tt -178.26 132.6 0.14 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.856 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 129.76 -145.82 16.8 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.495 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.6 t -129.41 148.23 51.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.845 0.355 . . . . 0.0 110.871 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -64.34 -39.08 93.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 45.2 p -66.43 -31.23 71.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.865 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.68 -53.04 24.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.893 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 mp -60.19 -50.75 72.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.857 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.906 0.384 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -145.62 149.26 34.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.899 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.73 -178.88 0.33 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.855 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.2 mp -131.46 114.58 26.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.116 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -106.57 168.37 9.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.733 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 76.6 p -137.28 148.96 46.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.067 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.417 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 28.9 t -103.55 -167.94 1.44 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.833 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -84.79 -47.75 10.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.803 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -70.51 -28.08 64.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.976 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.421 ' CE1' HD23 ' A' ' 14' ' ' LEU . 17.6 t80 -56.98 -30.87 64.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.99 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -75.44 -46.81 30.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.926 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.1 mtpp -66.86 -21.91 66.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.173 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.22 -28.67 23.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.817 0.341 . . . . 0.0 111.099 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.421 HD23 ' CE1' ' A' ' 10' ' ' PHE . 0.2 OUTLIER -79.28 -34.9 42.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.037 -179.883 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -56.81 -24.53 51.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.228 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.1 mm -80.36 -45.88 21.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.413 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.8 mp -72.65 -44.47 61.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.125 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.3 p -56.4 -30.04 29.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.224 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.15 -40.19 22.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.997 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -70.59 -62.61 1.32 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.946 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -178.86 75.35 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.51 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.421 ' CD2' HD12 ' A' ' 14' ' ' LEU . 86.0 t80 -153.03 137.51 16.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.805 0.336 . . . . 0.0 110.869 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.24 119.49 39.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.79 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.46 -23.67 26.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.182 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.5 tttm -59.2 -50.24 74.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.027 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.0 pp -57.86 -28.54 64.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.096 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.5 tt -64.88 -26.68 68.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.998 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -80.38 -28.09 38.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.172 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -87.53 -29.35 21.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.195 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.0 p -75.31 -25.73 18.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.328 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.5 p -47.23 -32.86 2.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.496 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.36 -26.44 74.56 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.454 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -88.5 -23.78 23.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.759 0.314 . . . . 0.0 111.139 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 34.1 mt -69.34 -38.12 78.0 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.922 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.64 -12.16 59.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.623 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.1 p -107.68 -44.55 4.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.839 0.352 . . . . 0.0 110.99 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 60.8 60.78 1.81 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.697 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.402 ' N ' ' CD ' ' A' ' 39' ' ' PRO . 1.1 mt-30 -91.64 -52.05 0.29 Allowed Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.519 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.402 ' CD ' ' N ' ' A' ' 38' ' ' GLN . 65.4 Cg_endo -80.29 -90.64 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 122.348 2.032 . . . . 0.0 112.988 -179.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 62.41 -167.54 0.2 Allowed 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.761 0.315 . . . . 0.0 110.716 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -112.38 137.41 21.57 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.997 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -73.58 -29.11 11.22 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.526 2.151 . . . . 0.0 112.37 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.71 -29.77 45.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.025 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -97.39 -53.3 3.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.995 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.52 149.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.833 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -97.28 147.31 24.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.86 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -172.82 159.71 3.72 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.953 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -56.34 177.19 0.16 Allowed 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.646 2.231 . . . . 0.0 112.377 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 11.1 mp -99.24 -54.96 2.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.838 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.2 mtmm -139.96 -176.71 4.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.854 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -91.66 -170.29 41.88 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.486 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 87.86 -71.89 2.53 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.461 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.94 -37.63 8.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.794 0.33 . . . . 0.0 110.905 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.57 28.07 13.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.02 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.7 -45.93 10.51 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.719 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -60.27 147.82 38.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.752 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.9 mtt85 -159.28 125.14 4.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.916 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -112.6 108.15 17.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.889 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.5 p -105.36 172.45 6.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.985 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 13.3 m-70 -124.52 83.2 2.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.84 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.2 pp -55.73 -40.78 72.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.032 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.1 mmtm -117.54 155.87 49.91 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -48.23 -25.85 7.47 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.733 2.289 . . . . 0.0 112.627 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -141.04 75.36 1.5 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.816 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -174.54 119.6 0.23 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.079 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -89.89 151.87 21.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.357 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.1 tt -145.3 97.58 3.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.919 0.39 . . . . 0.0 111.394 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.413 ' O ' ' N ' ' A' ' 81' ' ' VAL . 37.7 t -92.47 122.0 43.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.785 178.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.451 ' CD1' ' CD1' ' A' ' 71' ' ' ILE . 5.8 p90 -140.38 162.92 34.15 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.996 0.427 . . . . 0.0 111.412 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -144.26 108.08 4.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.575 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.451 ' CD1' ' CD1' ' A' ' 69' ' ' TYR . 1.5 mp -84.88 133.65 28.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.927 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.35 100.67 10.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.716 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -58.68 -21.77 55.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.343 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -55.0 -29.89 58.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.79 0.329 . . . . 0.0 111.161 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -144.37 16.12 1.67 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.392 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 46.94 72.1 0.27 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.865 0.364 . . . . 0.0 111.251 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 99.0 m -134.83 142.51 46.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.946 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.4 tt -99.64 93.11 5.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.726 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 3.6 t80 -92.2 107.62 19.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.877 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.418 HD12 ' CE2' ' A' ' 10' ' ' PHE . 2.1 mt -67.13 -179.85 1.04 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.563 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.413 ' N ' ' O ' ' A' ' 68' ' ' VAL . 43.9 t -154.25 -56.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.144 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.81 163.77 16.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.112 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -177.39 101.08 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.849 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -178.21 169.43 41.17 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.523 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.3 p -95.48 148.81 22.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.8 0.333 . . . . 0.0 110.841 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -68.63 -30.99 69.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.881 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.1 t -70.07 -39.65 75.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.95 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -76.73 -59.04 2.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.882 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.4 mp -59.8 -58.25 9.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.911 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.249 -0.882 . . . . 0.0 110.875 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.805 0.336 . . . . 0.0 111.14 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -123.07 148.38 45.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.908 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.99 -171.14 1.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.013 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.6 mp -137.06 135.89 47.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.042 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -133.58 162.71 31.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.83 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 41.0 p -138.09 147.82 44.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.988 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -105.44 171.85 7.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.997 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -43.91 87.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.974 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -65.05 -42.65 94.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.885 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.413 ' CZ ' HD11 ' A' ' 14' ' ' LEU . 13.3 t80 -59.22 -37.49 77.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.848 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -58.57 -30.49 67.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.825 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.8 mttp -82.11 -23.83 35.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.997 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.22 -23.81 43.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.159 -179.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.414 HD13 ' CE2' ' A' ' 22' ' ' PHE . 2.1 tp -89.96 -39.38 13.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.247 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.3 -30.43 62.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.125 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.9 mm -82.19 -29.26 9.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.128 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.1 mt -79.37 -36.94 38.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.015 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.3 p -65.26 -33.99 67.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.058 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -74.13 -31.3 62.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.963 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -87.67 -56.18 3.46 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.904 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -176.83 78.45 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.545 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.414 ' CE2' HD13 ' A' ' 14' ' ' LEU . 7.5 t80 -158.25 166.77 31.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.795 0.331 . . . . 0.0 110.819 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -130.99 170.95 13.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.928 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.66 -52.37 3.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.916 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.95 -28.91 68.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.974 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.46 -32.52 68.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.893 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 10.0 tt -77.49 -35.45 53.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.101 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -76.52 -23.43 53.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.969 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -88.73 -37.45 15.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.879 0.371 . . . . 0.0 111.002 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.1 p -66.08 -15.39 18.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.469 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 22.5 m -49.25 -39.29 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.13 0 CA-C-O 120.73 0.3 . . . . 0.0 111.325 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.57 -27.3 63.48 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.485 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -89.81 -31.52 17.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.881 0.372 . . . . 0.0 110.91 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 65.3 mt -62.3 -46.75 87.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.848 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.88 -33.57 74.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.116 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 76.2 p -81.75 -42.27 20.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.987 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 61.62 45.41 8.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.003 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.426 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 2.4 mt-30 -80.83 -52.3 0.89 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.17 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.426 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 50.4 Cg_endo -73.96 -85.5 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.13 1.887 . . . . 0.0 112.659 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mt 59.88 22.87 11.88 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.762 0.315 . . . . 0.0 111.233 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 61.71 119.28 0.02 OUTLIER Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.071 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -75.07 59.49 5.25 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.449 2.099 . . . . 0.0 112.428 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.438 ' HG3' ' CE2' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -153.13 -45.22 0.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.93 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.438 ' CE2' ' HG3' ' A' ' 43' ' ' LYS . 14.9 m-85 -97.78 -49.96 4.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.828 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 63.61 126.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.901 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -57.97 132.17 52.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.92 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 41.2 p-80 -139.21 148.59 57.74 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.89 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.74 160.94 45.14 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.485 2.123 . . . . 0.0 112.329 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.9 mt -100.92 -175.8 2.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.931 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.8 mtmt -166.56 106.92 0.66 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.885 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 154.37 49.79 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.578 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.57 -23.18 37.33 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.588 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.0 mt -108.56 87.56 2.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.812 0.339 . . . . 0.0 110.829 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -96.5 27.66 3.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.046 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -147.92 27.56 0.96 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.881 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -126.1 153.81 43.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.807 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 29.4 mtt85 -164.0 139.56 6.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.906 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.78 137.52 54.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.861 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.9 p -140.85 171.62 13.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.894 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -115.69 82.32 1.74 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.828 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -59.77 -30.41 68.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.032 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -136.1 149.99 69.85 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.903 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.31 129.17 30.33 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.583 2.189 . . . . 0.0 112.318 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 62.42 29.96 17.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.931 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.6 mp -139.72 118.32 12.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.925 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.91 173.07 8.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.535 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 48.0 tp -164.47 99.34 0.81 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.985 0.421 . . . . 0.0 111.474 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.42 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 40.0 t -96.76 124.14 49.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.896 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 7.5 p90 -138.48 155.99 47.94 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.034 0.445 . . . . 0.0 111.409 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -130.58 116.07 17.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.455 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.429 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.4 mp -84.85 128.02 39.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.934 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.401 ' HB2' ' CG ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -102.98 101.65 11.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.672 179.818 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.2 mtmt -58.55 -23.15 57.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.255 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.401 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 1.0 OUTLIER -52.9 -32.44 45.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.818 0.342 . . . . 0.0 111.01 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -145.2 16.48 1.53 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.307 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 45.97 71.76 0.27 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.805 0.336 . . . . 0.0 111.448 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.5 m -131.4 144.73 51.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.145 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 50.8 tp -101.27 89.66 3.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.41 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -89.98 120.79 31.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.804 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.2 mt -69.98 179.76 2.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.738 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.42 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 62.1 t -150.28 -66.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.094 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 -127.2 163.07 24.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.993 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.2 tt -168.86 152.54 5.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.044 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 121.82 -168.21 14.55 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.47 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 16.0 t -95.51 171.33 8.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.785 0.326 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -80.56 -30.65 37.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.876 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 91.0 p -85.09 -42.65 14.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.016 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -61.55 -38.73 88.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.84 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -72.91 -41.03 65.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.88 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.307 -0.854 . . . . 0.0 110.881 -179.985 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.881 0.372 . . . . 0.0 111.119 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -143.51 149.66 37.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.929 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.42 -175.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.865 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -131.1 121.18 48.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.115 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -118.64 167.9 11.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.75 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 59.7 p -142.1 151.1 42.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.963 0.411 . . . . 0.0 110.97 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.417 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 0.3 OUTLIER -112.74 -167.03 1.13 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.98 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.77 -49.32 14.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.856 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.9 mttp -61.22 -31.27 71.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.967 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -71.02 -47.07 60.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.939 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.32 -45.24 94.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.931 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.2 pttt -72.61 -16.04 61.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.375 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -84.43 -29.19 26.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.742 0.306 . . . . 0.0 111.108 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.6 mt -80.24 -36.47 34.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.071 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.8 pttt -58.67 -25.69 63.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.137 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.1 mm -85.13 -29.51 6.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.277 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.1 mt -82.89 -37.13 24.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.05 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.4 p -58.21 -30.4 39.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.051 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -30.75 34.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.916 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -98.76 31.04 3.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.86 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.01 94.3 0.75 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.571 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -175.13 100.61 0.08 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.737 0.303 . . . . 0.0 110.868 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.22 -177.51 0.53 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.905 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 40.3 mt -110.78 -31.32 7.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.963 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.26 -27.85 66.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.06 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.2 pp -57.17 -43.74 82.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.038 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.08 -48.25 82.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.974 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -62.23 -20.12 63.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.081 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -88.32 -29.96 19.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.999 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 34.0 t -81.97 -26.36 9.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.28 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 28.1 m -54.26 -31.65 22.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.285 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.24 -32.17 83.22 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.419 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -90.01 -28.4 19.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.673 0.273 . . . . 0.0 110.85 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 72.1 mt -62.23 -39.73 93.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.898 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.37 -41.13 85.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.103 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.3 p -77.85 -36.61 49.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.893 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 61.25 43.71 10.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.053 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.414 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -92.83 -52.67 0.26 Allowed Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.211 -179.898 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.414 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 72.6 Cg_endo -84.12 -91.57 0.0 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.548 2.165 . . . . 0.0 112.783 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mt 57.87 36.27 26.17 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.83 0.348 . . . . 0.0 110.876 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 64.0 132.97 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.026 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -77.87 -1.16 11.34 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.571 2.181 . . . . 0.0 112.825 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.421 ' HG2' ' CD2' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -109.51 16.79 22.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.35 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.421 ' CD2' ' HG2' ' A' ' 43' ' ' LYS . 43.6 m-85 -146.49 -65.9 0.29 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.85 0.357 . . . . 0.0 110.871 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.1 mtpp 62.6 121.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.912 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -57.96 143.77 41.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.991 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.429 ' CG ' ' HD2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -154.61 156.33 31.44 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.797 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.429 ' HD2' ' CG ' ' A' ' 47' ' ' HIS . 43.1 Cg_endo -67.75 166.5 24.07 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.577 2.184 . . . . 0.0 112.332 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.03 -53.41 4.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.816 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -148.35 -177.48 5.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.008 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -110.15 46.09 1.22 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.524 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.17 12.67 6.39 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.751 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 179.35 -42.34 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.943 0.402 . . . . 0.0 110.863 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? 58.79 29.48 18.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.974 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -92.73 -37.35 12.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.802 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -88.42 153.65 21.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.982 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -164.04 147.08 9.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.712 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -131.45 134.2 45.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.993 0.425 . . . . 0.0 111.151 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 25.0 p -125.46 -175.25 3.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.645 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -135.85 81.7 1.9 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.21 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.413 ' HG ' ' N ' ' A' ' 62' ' ' LYS . 1.3 pt? -59.93 -33.35 71.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.797 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.435 ' HG3' ' HD2' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -113.6 141.57 26.21 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.341 179.74 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.435 ' HD2' ' HG3' ' A' ' 62' ' ' LYS . 9.4 Cg_endo -52.38 -20.46 11.62 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.651 2.234 . . . . 0.0 112.784 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -130.25 36.75 3.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.193 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.403 ' HB2' ' HB3' ' A' ' 62' ' ' LYS . 56.1 mt -151.82 164.86 36.15 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.944 0.402 . . . . 0.0 111.201 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -126.28 179.81 5.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.125 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.2 tt -170.03 102.92 0.3 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.822 0.344 . . . . 0.0 111.301 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.402 ' O ' ' N ' ' A' ' 81' ' ' VAL . 21.8 t -89.78 138.19 19.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.312 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -147.04 177.15 9.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.074 0.464 . . . . 0.0 111.344 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -148.0 123.04 10.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.474 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 3.0 mm -84.69 138.41 19.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.342 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.77 87.63 2.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.657 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -22.11 21.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.177 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -46.73 -33.53 4.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.2 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -147.2 20.04 1.23 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.318 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 29.7 m120 48.21 69.33 0.56 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.872 0.368 . . . . 0.0 111.232 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 52.2 m -135.1 137.68 43.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.966 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 35.9 tp -94.53 93.22 7.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.591 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.8 t80 -89.89 111.78 22.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.834 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -71.96 171.53 11.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.88 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.402 ' N ' ' O ' ' A' ' 68' ' ' VAL . 66.0 t -137.61 -72.72 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.162 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.0 mmm-85 -116.19 170.56 8.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.922 0.391 . . . . 0.0 111.047 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 9.4 tt -177.62 135.16 0.18 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.771 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 146.38 -168.68 27.78 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.558 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -96.47 144.24 26.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.816 0.341 . . . . 0.0 110.812 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -35.41 73.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.948 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 31.9 m -77.01 -47.1 21.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.96 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.46 -51.04 71.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.955 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.36 -31.08 71.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.863 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.846 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.9 mtp . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.799 0.333 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -107.25 -179.07 3.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.867 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.4 -171.89 2.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.89 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -130.76 126.72 60.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.165 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -124.73 166.49 16.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.846 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 71.3 p -142.0 159.68 41.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.962 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -125.49 172.49 9.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.98 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -44.71 96.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.965 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.6 mttm -62.93 -31.25 72.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.769 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.418 ' CZ ' HD13 ' A' ' 14' ' ' LEU . 76.4 t80 -67.94 -34.88 77.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.839 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -69.77 -30.12 67.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.041 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.85 -21.07 55.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.259 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.44 -46.36 9.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.807 0.337 . . . . 0.0 111.036 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.418 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 1.4 tp -63.43 -37.62 87.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.079 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.3 ptpt -57.44 -22.95 46.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.269 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 26.9 mm -85.88 -36.65 10.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.312 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.8 mt -78.58 -35.54 45.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.152 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.0 p -58.16 -33.28 46.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.144 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt -74.87 -30.47 61.33 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.921 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -102.38 30.02 4.84 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.856 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.74 92.53 1.01 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.548 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -176.76 94.96 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.796 0.331 . . . . 0.0 110.861 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.12 -179.06 0.7 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.887 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.2 mp -108.08 -31.74 7.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.851 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.42 -26.03 63.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.042 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.9 pp -56.6 -38.3 71.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.132 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.4 tt -64.1 -37.35 87.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.918 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.63 -27.0 65.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.031 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.68 -31.67 20.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.885 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 24.6 t -67.07 -21.76 28.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.342 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.2 p -49.98 -29.35 5.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.286 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -71.1 -38.54 63.59 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.46 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -79.81 -26.15 40.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.804 0.335 . . . . 0.0 110.911 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 77.6 mt -73.49 -29.06 62.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.946 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.33 -29.72 42.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.251 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.0 p -96.38 -38.88 9.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.048 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 60.89 72.71 0.51 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.792 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.08 -54.31 0.17 Allowed Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.634 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -83.69 -79.26 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.305 2.004 . . . . 0.0 113.111 -179.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.2 mm? 46.7 40.73 9.11 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.846 0.355 . . . . 0.0 111.444 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.403 ' HA ' ' HD3' ' A' ' 42' ' ' PRO . . . 63.2 127.31 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.254 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 41' ' ' ALA . 25.6 Cg_exo -62.43 -25.63 76.19 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.494 2.129 . . . . 0.0 112.418 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -30.94 58.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.325 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -108.15 -62.6 1.43 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.054 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.9 mttt 63.72 31.35 14.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.804 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.7 t70 59.89 161.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.944 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -171.26 161.26 5.28 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.766 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.52 160.92 47.94 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.551 2.167 . . . . 0.0 112.322 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.92 -48.51 3.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.812 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? 60.7 -174.22 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.941 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.67 48.61 5.78 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.477 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.71 28.38 55.01 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.509 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -176.09 92.29 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.866 0.365 . . . . 0.0 110.878 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -86.64 -27.18 23.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.993 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -63.79 -42.29 97.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.888 0.375 . . . . 0.0 110.891 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -60.76 156.27 17.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.83 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.2 mtm-85 -165.78 175.58 8.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.859 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -159.65 118.78 2.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.918 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.2 p -121.71 -176.88 3.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.852 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.405 ' CE1' HD21 ' A' ' 66' ' ' LEU . 7.3 m-70 -133.84 86.21 2.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.899 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.0 pp -59.11 -33.42 70.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.862 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.6 mtmt -111.4 167.31 9.25 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.77 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.29 -12.85 37.32 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.501 2.134 . . . . 0.0 112.482 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -154.7 54.42 0.67 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.727 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -151.04 125.69 9.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.908 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.405 HD21 ' CE1' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -91.87 161.53 14.8 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.612 179.709 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.409 HD22 ' CD1' ' A' ' 69' ' ' TYR . 5.7 tt -160.5 94.1 1.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.911 0.386 . . . . 0.0 111.112 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.406 ' O ' ' N ' ' A' ' 81' ' ' VAL . 34.7 t -89.96 136.33 24.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.341 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.409 ' CD1' HD22 ' A' ' 67' ' ' LEU . 11.9 p90 -154.39 154.03 32.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.852 0.358 . . . . 0.0 111.272 -179.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.79 123.01 24.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.783 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.424 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.5 mp -88.42 126.81 41.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.784 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.59 99.7 11.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.681 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.69 -23.05 26.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.204 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 -50.97 -34.63 29.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.909 0.385 . . . . 0.0 111.047 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -143.89 16.82 1.77 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.202 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 m120 47.62 68.74 0.61 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.757 0.313 . . . . 0.0 111.343 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 97.9 m -128.32 138.68 52.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.052 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.409 HD23 ' CD2' ' A' ' 69' ' ' TYR . 1.2 tt -95.74 92.06 6.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.721 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.413 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 3.9 t80 -91.48 118.03 30.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.882 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.413 ' O ' ' CE1' ' A' ' 79' ' ' PHE . 4.8 mt -76.14 179.38 5.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.69 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.406 ' N ' ' O ' ' A' ' 68' ' ' VAL . 90.9 t -150.36 -73.89 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.113 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.4 mtp85 -98.03 167.86 10.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.956 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -178.3 90.14 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.876 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 176.49 175.74 44.08 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.402 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.9 t -98.01 151.58 20.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.901 0.381 . . . . 0.0 110.842 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -68.04 -47.58 68.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.922 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 29.7 p -60.54 -31.89 70.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.858 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.86 -60.52 2.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.872 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.8 mp -60.22 -32.97 71.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.887 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.219 -0.895 . . . . 0.0 110.854 -179.96 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 ttt . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.832 0.348 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.73 133.64 51.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.891 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -178.52 0.05 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.964 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -127.81 120.93 55.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.132 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -112.56 165.5 12.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.735 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 71.6 p -134.47 149.65 50.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.056 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.427 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 1.4 t -105.43 -172.24 2.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.936 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -75.96 -54.72 6.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.821 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -64.46 -33.17 75.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.799 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.422 ' CZ ' HD11 ' A' ' 80' ' ' LEU . 89.6 t80 -61.93 -30.09 70.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.906 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -68.99 -53.29 21.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.038 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.5 ptmm? -70.84 -10.37 59.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.48 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -85.82 -27.97 24.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.713 0.292 . . . . 0.0 110.946 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tp -83.44 -34.79 25.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.058 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.9 pttt -59.02 -29.24 67.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.169 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.2 mm -76.08 -39.46 36.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.327 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.7 mt -70.76 -44.22 67.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.014 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.1 p -59.76 -28.42 40.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.066 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -78.44 -30.51 47.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.887 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -87.27 -39.8 15.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.966 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 159.56 76.14 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.601 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -147.05 165.84 28.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.808 0.337 . . . . 0.0 110.862 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -125.3 165.98 17.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.963 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.9 mp -90.28 -54.25 4.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.8 mmtt -58.24 -22.96 54.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.1 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -54.21 -52.74 60.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.033 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.6 -30.65 70.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.96 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -73.24 -26.45 61.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.085 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.23 -33.79 24.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.005 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 41.0 t -71.59 -16.82 19.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.447 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.2 t -49.53 -28.33 3.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 120.828 0.347 . . . . 0.0 111.26 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -73.5 -26.72 69.2 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.42 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -90.11 -29.3 18.41 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.758 0.313 . . . . 0.0 110.857 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.3 mt -66.04 -37.92 87.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.904 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.47 -31.61 60.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.111 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 43.4 p -82.51 -44.03 16.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.853 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 61.29 51.9 4.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.945 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -93.55 -53.02 0.25 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.139 -179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -85.12 -88.97 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.513 2.142 . . . . 0.0 112.726 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 56.17 28.79 13.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.801 0.334 . . . . 0.0 111.127 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 61.66 116.44 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.053 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -66.85 -26.27 44.8 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.424 2.083 . . . . 0.0 112.324 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.71 -30.82 71.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.986 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -108.71 -59.51 1.87 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.956 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.4 mttm 63.99 134.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.944 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -66.73 155.15 38.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.954 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 10.9 p-80 -171.48 156.18 4.29 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.897 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.48 170.59 10.74 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.616 2.211 . . . . 0.0 112.19 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.5 mt -104.41 -48.06 3.93 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.023 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.61 140.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.874 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 112.77 43.18 0.89 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.415 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.78 -32.93 6.49 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.533 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.1 mt -113.03 62.26 0.64 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.911 0.386 . . . . 0.0 110.803 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -41.6 83.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.98 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -59.67 -31.39 69.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.944 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -74.94 141.72 44.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.858 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.3 mtt180 -156.74 152.91 27.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.849 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -131.39 149.5 52.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.025 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 32.1 p -139.54 -173.25 3.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.778 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 75.9 m-70 -138.86 85.04 2.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.948 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.1 pp -64.81 -41.08 96.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.816 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 mttt -102.65 166.61 11.65 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.833 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.85 -12.28 34.85 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.576 2.184 . . . . 0.0 112.425 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -154.33 52.05 0.66 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.888 0.375 . . . . 0.0 110.614 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -152.6 127.78 9.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.955 -179.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.92 166.33 13.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.502 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 43.9 tp -159.46 98.57 1.41 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.967 0.413 . . . . 0.0 111.614 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.439 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 19.9 t -95.08 124.74 47.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.691 178.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.462 ' CD1' ' CD1' ' A' ' 71' ' ' ILE . 7.8 p90 -141.18 163.39 33.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.128 0.49 . . . . 0.0 111.534 -179.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -141.66 107.62 5.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.399 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.462 ' CD1' ' CD1' ' A' ' 69' ' ' TYR . 1.5 mp -84.88 146.28 6.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.014 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.17 104.72 10.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.693 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -59.96 -21.02 60.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.176 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.1 tp-100 -52.46 -33.6 45.2 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.104 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -144.32 17.19 1.7 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.268 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 47.38 74.79 0.15 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.894 0.378 . . . . 0.0 111.234 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 82.3 m -134.46 148.72 50.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.996 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.2 tt -107.67 93.04 4.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.63 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.427 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.7 t80 -89.99 105.74 18.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.991 -179.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.422 HD11 ' CZ ' ' A' ' 10' ' ' PHE . 3.8 mt -65.73 -179.38 0.67 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.521 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.439 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 59.9 t -154.81 -59.53 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.24 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.25 165.95 11.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.85 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.415 ' HB2' ' CE1' ' A' ' 10' ' ' PHE . 0.2 OUTLIER -177.84 99.16 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.963 -179.944 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 165.29 -161.39 34.8 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.39 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.2 p -123.03 155.51 36.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.751 0.31 . . . . 0.0 110.976 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -69.17 -31.53 70.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.97 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.1 t -74.78 -34.98 62.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.945 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.93 -57.2 4.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.898 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.2 mp -61.04 -70.8 0.16 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.971 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.818 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mmt . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.825 0.345 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -144.71 145.91 31.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.844 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.26 -173.61 4.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.882 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.4 mp -139.9 112.98 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.99 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -112.41 162.45 15.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.749 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 74.4 p -141.95 143.3 33.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.074 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.27 175.28 9.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.968 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.5 mtmt -64.79 -45.74 85.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.836 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -61.14 -21.71 64.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.092 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.418 ' CZ ' ' HB2' ' A' ' 83' ' ' LEU . 1.0 OUTLIER -65.31 -32.45 74.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.004 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.12 -44.43 79.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.935 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.23 -8.85 59.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.371 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.14 -27.27 19.72 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.669 0.271 . . . . 0.0 111.257 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.9 -41.71 11.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.462 -179.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.6 pttm -54.67 -24.31 21.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.345 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.2 mm -83.43 -32.16 8.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.108 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 91.2 mt -82.03 -38.05 25.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.051 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.0 p -59.27 -30.48 44.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.115 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.31 -45.89 24.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.819 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -71.66 -31.6 67.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.82 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 149.56 75.98 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.543 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -153.7 165.46 35.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.876 0.369 . . . . 0.0 110.907 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -145.51 164.5 31.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.821 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.6 mp -94.77 -29.04 14.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.948 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -33.35 69.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.919 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.4 pp -74.1 -30.66 62.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.021 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 7.3 tt -73.78 -25.99 60.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.137 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -81.01 -28.58 35.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.094 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.73 -36.11 17.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.042 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.1 p -62.6 -21.12 26.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.392 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 27.8 m -47.68 -32.56 2.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.834 0.349 . . . . 0.0 111.462 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.83 -26.52 74.29 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.474 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -89.88 -27.38 19.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.744 0.307 . . . . 0.0 110.967 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 69.2 mt -66.49 -43.93 84.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.015 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.03 -37.43 72.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.276 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 53.3 p -78.7 -41.44 31.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.021 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 62.08 49.95 4.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.87 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.458 ' H ' ' HD2' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -98.76 -61.76 0.11 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.641 -179.827 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.458 ' HD2' ' H ' ' A' ' 38' ' ' GLN . 30.1 Cg_endo -63.66 -85.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.274 1.983 . . . . 0.0 112.958 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.1 mm? 47.61 -173.1 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.801 0.334 . . . . 0.0 111.376 -179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -105.25 145.64 31.16 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.12 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.72 -28.92 7.62 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.618 2.212 . . . . 0.0 112.352 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -76.71 -27.28 55.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.044 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.501 ' CD2' ' CG ' ' A' ' 60' ' ' HIS . 19.8 m-85 -105.29 -54.6 2.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.926 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.92 147.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.803 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -87.19 134.53 33.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.976 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -173.22 162.44 3.48 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.857 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -67.96 -177.88 1.47 Allowed 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.583 2.189 . . . . 0.0 112.264 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.8 mp -103.76 -69.29 0.81 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.995 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -178.61 159.42 1.13 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.883 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 111.71 -166.57 12.25 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.551 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -110.82 -20.05 7.44 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.643 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.35 -47.02 69.75 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.837 0.351 . . . . 0.0 111.235 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 58.61 29.73 18.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.041 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -104.56 -31.46 9.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.804 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -89.89 137.42 32.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.844 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.3 mtt180 -154.34 148.64 26.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.862 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -118.2 150.04 40.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.04 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 30.4 p -148.47 151.41 35.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.857 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.501 ' CG ' ' CD2' ' A' ' 44' ' ' TYR . 17.2 m-70 -107.83 92.42 4.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.899 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.3 pp -68.04 -30.87 70.19 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.782 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.401 ' HG3' ' HD2' ' A' ' 63' ' ' PRO . 33.2 tptt -140.24 139.55 21.23 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.61 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.401 ' HD2' ' HG3' ' A' ' 62' ' ' LYS . 96.8 Cg_exo -43.44 132.96 7.07 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.565 2.177 . . . . 0.0 112.419 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 65.87 25.58 11.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.799 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.81 120.0 9.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.712 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -101.43 -178.25 3.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.679 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.8 tt -167.92 103.55 0.48 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.071 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.418 ' O ' ' N ' ' A' ' 81' ' ' VAL . 24.8 t -94.88 138.98 19.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.543 179.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -147.85 161.95 40.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 0.0 111.31 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -128.52 120.24 26.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.438 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 3.0 mm -84.71 141.51 14.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.38 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.45 87.5 2.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.695 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -56.39 -22.53 32.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.248 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -50.11 -32.82 16.83 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.891 0.377 . . . . 0.0 111.118 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -142.9 16.6 1.95 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.179 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 47.43 68.3 0.67 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.843 0.354 . . . . 0.0 111.22 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 88.7 m -133.41 136.29 45.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.911 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 34.3 tp -95.06 92.37 6.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.727 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -90.08 115.74 27.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.966 -179.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.405 ' HB3' ' CE2' ' A' ' 10' ' ' PHE . 30.6 mt -73.27 171.52 12.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.742 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.418 ' N ' ' O ' ' A' ' 68' ' ' VAL . 57.9 t -133.51 -70.22 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.291 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -118.45 175.78 5.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.117 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.418 ' HB2' ' CZ ' ' A' ' 10' ' ' PHE . 0.4 OUTLIER -173.47 90.96 0.08 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.849 -179.983 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.62 127.92 1.49 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.749 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.33 154.91 4.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.829 0.347 . . . . 0.0 111.127 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.84 -33.59 75.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.897 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.36 -32.35 60.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.875 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -67.18 -48.06 69.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.912 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.91 -39.23 93.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.823 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.288 -0.863 . . . . 0.0 110.868 -179.999 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.5 ttt . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.88 0.371 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.86 136.63 43.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.808 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.96 -176.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.015 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -136.36 115.26 15.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.994 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -108.64 159.68 16.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.813 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 39.9 p -139.19 150.05 45.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.926 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.41 ' HB2' ' CZ ' ' A' ' 79' ' ' PHE . 0.1 OUTLIER -118.19 -168.83 1.59 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.944 179.975 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -78.07 -46.08 21.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.898 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -61.47 -33.79 74.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.416 ' CZ ' HD12 ' A' ' 14' ' ' LEU . 13.2 t80 -69.88 -37.68 76.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -72.94 -29.52 63.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.978 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -76.22 -23.19 54.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.153 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.37 -46.79 11.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.069 -179.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.416 HD12 ' CZ ' ' A' ' 10' ' ' PHE . 81.0 mt -59.79 -37.46 79.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.096 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt -56.95 -26.83 60.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.141 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.414 HG23 HD12 ' A' ' 16' ' ' ILE . 25.9 mm -82.45 -33.65 11.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.172 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.3 mt -79.99 -41.3 26.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.033 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.6 p -57.84 -29.55 35.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.157 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.2 tttt -81.21 -31.22 34.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.93 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -100.43 30.39 3.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.971 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.11 95.3 0.81 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.592 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.409 ' CZ ' HD13 ' A' ' 26' ' ' LEU . 11.4 t80 -176.6 113.39 0.1 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.814 0.34 . . . . 0.0 110.831 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.405 ' O ' ' CD1' ' A' ' 22' ' ' PHE . 5.0 m-20 -74.85 160.39 30.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.956 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.82 -28.2 14.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.993 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.9 mtmm -69.23 -29.6 67.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.957 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.409 HD13 ' CZ ' ' A' ' 22' ' ' PHE . 4.4 pp -58.6 -30.97 67.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.953 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.99 -23.91 55.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.159 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -82.44 -30.55 29.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.785 0.326 . . . . 0.0 111.003 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -88.31 -33.46 18.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.031 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.8 p -62.74 -21.52 27.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.321 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 36.1 t -47.5 -38.33 5.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.293 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.27 -32.57 84.64 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.387 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -89.99 -23.19 21.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.748 0.309 . . . . 0.0 111.173 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.3 mt -69.77 -40.44 76.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.054 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.8 -36.6 67.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.276 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.7 p -83.32 -42.5 17.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.93 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.413 ' HA ' ' CD1' ' A' ' 40' ' ' LEU . 13.3 mt-10 61.04 58.67 2.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.857 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.4 ' N ' ' CD ' ' A' ' 39' ' ' PRO . 0.5 OUTLIER -88.71 -51.74 0.38 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.517 -179.65 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.4 ' CD ' ' N ' ' A' ' 38' ' ' GLN . 63.1 Cg_endo -77.82 -91.29 0.0 OUTLIER 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 122.174 1.916 . . . . 0.0 112.696 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.413 ' CD1' ' HA ' ' A' ' 37' ' ' GLU . 3.1 mp 56.51 -178.85 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.801 0.334 . . . . 0.0 111.038 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -94.78 142.15 24.3 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.0 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -74.73 -24.47 13.39 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.553 2.169 . . . . 0.0 112.47 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.54 -29.23 26.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.093 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -95.36 -62.11 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.109 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 mmtt 62.33 149.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.847 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.4 ' HB2' ' CD2' ' A' ' 40' ' ' LEU . 40.8 t0 -93.72 142.5 27.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.997 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.5 p-80 -154.85 142.29 13.85 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.76 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -73.57 -168.2 0.43 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.482 2.121 . . . . 0.0 112.405 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mt -132.79 -174.95 3.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.751 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -158.12 172.37 18.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.937 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 75.01 50.13 8.94 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.369 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 106.36 -22.0 31.8 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.486 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.1 mt -122.46 93.98 4.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.689 0.28 . . . . 0.0 110.856 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.5 mmtp -101.64 -41.99 6.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.953 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 -72.35 -30.15 64.46 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.947 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -62.3 139.49 58.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.857 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 56.1 mtm180 -154.65 135.45 13.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.847 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -110.39 119.18 38.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.849 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 24.7 p -127.0 144.61 50.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.781 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -108.06 83.17 1.75 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.028 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 pp -59.04 -32.41 69.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.671 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.413 ' CB ' ' HD2' ' A' ' 63' ' ' PRO . 0.3 OUTLIER -113.62 170.06 5.77 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.679 179.815 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.413 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 55.1 Cg_endo -70.1 -8.38 23.47 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.384 2.056 . . . . 0.0 112.781 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -151.43 40.69 0.69 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.739 0.304 . . . . 0.0 111.137 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 27.4 mt -131.59 133.7 45.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.052 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.96 116.16 28.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.716 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -113.97 94.62 4.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.998 0.428 . . . . 0.0 111.143 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.536 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 26.2 t -96.84 69.87 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.841 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.425 ' CE1' HD12 ' A' ' 71' ' ' ILE . 3.1 p90 -89.51 177.14 6.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.098 0.475 . . . . 0.0 111.345 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -146.15 122.51 10.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.709 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.428 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.5 mp -92.65 138.17 20.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.852 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.09 102.5 11.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.658 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.63 -20.5 56.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.263 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -52.88 -29.42 28.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.734 0.302 . . . . 0.0 111.081 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -149.23 19.13 0.96 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.277 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 34.8 m120 46.46 74.77 0.14 Allowed 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.731 0.3 . . . . 0.0 111.303 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 53.9 m -133.81 147.45 51.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.165 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.4 95.59 5.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.553 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.41 ' CZ ' ' HB2' ' A' ' 7' ' ' SER . 5.4 t80 -89.9 111.65 22.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.866 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -68.23 168.96 11.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.607 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.536 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 98.3 t -152.02 -84.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.432 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 11.1 mtm-85 -96.23 160.44 14.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.865 0.364 . . . . 0.0 111.254 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -179.64 114.22 0.05 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.612 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 145.55 -159.93 28.0 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.42 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.22 141.05 51.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.809 0.338 . . . . 0.0 110.828 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -58.95 -30.35 67.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.914 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.1 m -78.23 -32.68 49.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.922 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -70.0 -46.88 64.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.958 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.0 mp -60.09 -31.51 70.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.92 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.965 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 ptp . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.899 0.38 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -128.82 133.52 48.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.922 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.51 -175.57 0.27 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.841 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.2 mp -133.37 116.19 24.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.108 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -110.19 168.18 9.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.81 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 77.6 p -138.41 147.93 43.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.894 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.409 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 2.6 t -105.71 -168.19 1.42 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.886 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -74.53 -58.18 3.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.966 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -58.88 -34.56 71.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.964 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -60.29 -34.86 74.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.927 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.32 -35.02 63.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.862 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.7 mtpp -82.11 -20.96 37.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.087 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -84.1 -28.44 27.52 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.139 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -83.8 -36.49 23.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.161 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 12.6 pttp -58.6 -29.98 66.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.055 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.42 HG21 HD12 ' A' ' 16' ' ' ILE . 27.4 mm -83.62 -33.24 9.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.118 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.1 mt -73.68 -43.14 60.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.912 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.2 p -60.24 -30.93 47.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.11 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -72.92 -33.74 66.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.804 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -84.97 -48.74 8.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.927 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 163.3 76.95 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.501 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.421 ' CZ ' HD13 ' A' ' 26' ' ' LEU . 56.4 t80 -153.07 116.8 4.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.858 0.361 . . . . 0.0 110.908 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.47 156.13 24.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.866 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.3 mp -91.36 -29.93 16.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.913 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -58.81 -36.87 75.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.97 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.421 HD13 ' CZ ' ' A' ' 22' ' ' PHE . 3.9 pp -66.35 -30.67 71.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.885 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 9.1 tp -71.71 -29.07 64.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.983 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -83.21 -25.22 31.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.956 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 mttt -88.04 -34.45 17.99 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.075 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.4 p -60.28 -19.63 18.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.331 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 29.4 m -48.7 -41.06 12.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.827 0.346 . . . . 0.0 111.362 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.66 -27.5 66.42 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.371 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -89.29 -30.01 18.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 0.0 110.871 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.3 mt -63.38 -38.07 89.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.873 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.93 -51.97 14.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.079 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.5 p -66.35 -44.54 82.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.917 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 60.42 51.92 5.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.891 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.41 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 0.5 OUTLIER -91.31 -52.12 0.3 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.233 -179.841 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.41 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 74.3 Cg_endo -84.18 -92.13 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.406 2.071 . . . . 0.0 112.684 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 54.55 36.78 26.63 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-O 120.849 0.357 . . . . 0.0 111.143 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.54 127.95 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.08 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -77.27 -3.4 13.65 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.482 2.121 . . . . 0.0 112.832 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -102.63 -32.38 9.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 0.0 111.023 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -95.25 -52.68 4.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.904 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.2 mmtt 62.69 148.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.794 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 59.5 t0 -91.51 139.56 30.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.949 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 11.8 p-80 -158.42 146.42 13.78 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.79 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -73.18 -175.55 2.02 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.532 2.155 . . . . 0.0 112.337 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 35.7 mt -98.46 -69.75 0.75 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.883 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -140.84 95.08 2.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.818 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -63.34 122.4 26.87 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.53 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 112.3 27.92 3.74 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.634 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.4 pp -179.04 -38.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.851 0.358 . . . . 0.0 111.014 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.4 mmtt -132.96 129.7 38.59 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.926 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -94.74 20.29 8.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.029 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -78.02 143.98 37.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.832 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -156.4 142.8 18.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.595 -179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -128.5 148.89 50.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.124 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 32.1 p -137.15 -172.46 3.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.631 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 28.3 m-70 -143.73 85.84 1.85 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.981 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.01 -43.43 98.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.75 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.51 166.36 13.03 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.859 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.39 -3.53 14.02 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.749 2.299 . . . . 0.0 112.972 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -147.59 33.83 0.86 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.609 0.242 . . . . 0.0 111.08 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 mp -151.84 145.59 25.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.903 0.382 . . . . 0.0 111.098 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -110.53 -173.19 2.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.293 179.602 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.4 HD21 ' CD1' ' A' ' 80' ' ' LEU . 4.1 tt -169.99 103.58 0.31 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.876 0.37 . . . . 0.0 111.431 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.404 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 13.7 t -94.66 120.95 44.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.09 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -137.78 159.54 41.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.004 0.431 . . . . 0.0 111.433 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -132.42 122.74 25.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.505 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 3.0 mm -84.74 131.04 34.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.41 -179.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.82 85.02 2.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.665 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.0 mttt -56.19 -23.02 32.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.264 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -51.97 -30.38 24.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.845 0.355 . . . . 0.0 111.047 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -142.25 16.47 2.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.311 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 47.05 69.31 0.51 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.858 0.361 . . . . 0.0 111.311 179.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 49.3 m -139.13 143.67 38.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.067 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.29 96.45 8.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.668 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.409 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 3.7 t80 -94.39 114.19 26.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.945 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.408 ' O ' ' CE1' ' A' ' 79' ' ' PHE . 3.0 mm? -69.62 169.86 11.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.797 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.404 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 35.1 t -136.41 -63.66 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.069 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.8 ttt85 -133.07 172.52 12.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.914 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.9 tt -176.84 146.53 0.55 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.949 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.94 129.52 6.64 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.488 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -52.68 138.93 27.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.84 0.352 . . . . 0.0 111.09 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -30.12 66.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.936 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.9 p -64.65 -32.96 74.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -73.73 -44.81 55.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.91 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.0 mp -64.58 -66.99 0.47 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.868 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.2 mtt . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.771 0.32 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.1 mt -102.77 151.66 22.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.898 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.39 -177.32 1.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.862 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.8 mp -133.8 116.91 24.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.196 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -110.49 159.81 17.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.712 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 34.2 p -130.93 149.85 52.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.115 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.9 t -106.13 -166.8 1.23 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.8 mtmm -82.85 -52.09 7.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.027 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.4 mmtp -70.24 -31.77 69.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.027 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.428 ' CZ ' ' HG ' ' A' ' 80' ' ' LEU . 76.4 t80 -59.95 -53.66 55.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.884 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.29 -31.03 68.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.988 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -82.35 -20.03 38.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.179 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -85.37 -28.36 25.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.19 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.412 HD12 ' CZ ' ' A' ' 10' ' ' PHE . 3.9 mp -81.59 -37.65 27.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.162 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.1 ptpt -58.27 -29.77 66.07 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.089 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.1 mm -81.05 -43.81 20.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.069 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.405 ' HB3' ' CD2' ' A' ' 22' ' ' PHE . 2.1 mm? -56.62 -26.84 56.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.924 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.6 t -57.41 -54.59 28.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.126 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.1 tptm -59.18 -28.67 66.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.08 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -97.84 33.57 2.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.973 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.79 88.35 0.38 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.486 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.42 ' CE1' HD12 ' A' ' 26' ' ' LEU . 7.4 t80 -176.56 166.84 2.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.74 0.305 . . . . 0.0 110.838 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -157.01 158.99 37.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.912 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -88.39 -29.68 20.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.003 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -63.58 -45.2 91.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.906 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.42 HD12 ' CE1' ' A' ' 22' ' ' PHE . 4.3 pp -60.1 -31.63 70.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.921 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.7 tt -76.26 -28.7 57.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.913 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.11 -29.49 67.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.907 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.61 -30.85 18.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.055 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 34.6 t -64.38 -22.49 31.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.247 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 29.1 m -50.35 -29.29 6.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.226 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -70.0 -33.74 70.24 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.397 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -86.32 -28.93 23.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.739 0.304 . . . . 0.0 110.881 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.0 mt -63.25 -38.31 90.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.831 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.24 -34.9 61.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.185 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 51.4 p -78.86 -41.35 30.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.837 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.438 ' HA ' HD22 ' A' ' 40' ' ' LEU . 26.8 mt-10 58.07 61.39 2.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.972 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.425 ' CB ' ' HD3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -102.48 -55.18 0.12 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.411 -179.79 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.425 ' HD3' ' CB ' ' A' ' 38' ' ' GLN . 41.7 Cg_endo -86.04 -76.36 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.379 2.053 . . . . 0.0 112.338 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.438 HD22 ' HA ' ' A' ' 37' ' ' GLU . 2.5 mm? 48.65 27.65 1.57 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.814 0.34 . . . . 0.0 111.433 179.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 62.11 121.01 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.116 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.95 -35.78 90.54 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.425 2.084 . . . . 0.0 112.388 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.73 -30.45 68.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.852 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -109.63 63.86 0.61 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.857 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.7 mttp -60.29 102.5 0.18 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.815 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -51.56 145.33 9.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.087 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -168.28 162.97 8.82 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.914 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.18 172.73 14.21 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.605 2.204 . . . . 0.0 112.353 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.91 -45.11 9.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.827 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt 68.69 151.74 0.09 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.952 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 111.35 -97.22 0.93 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.44 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -106.91 23.5 27.52 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.578 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 179.94 114.61 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.904 0.383 . . . . 0.0 110.8 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.4 -38.4 9.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.856 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.61 -18.23 61.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.182 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -94.0 125.35 38.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.882 0.372 . . . . 0.0 110.908 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -145.07 155.26 43.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.783 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -121.66 154.57 36.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.003 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.3 m -145.76 -169.99 3.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.895 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -139.03 110.8 7.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.898 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.402 ' CD2' ' CD1' ' A' ' 67' ' ' LEU . 3.7 pp -83.17 -38.26 22.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.85 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.41 ' CB ' ' HD2' ' A' ' 63' ' ' PRO . 2.7 mttm -108.13 169.36 6.69 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.788 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.41 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 47.5 Cg_endo -68.8 -9.39 26.1 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.466 2.11 . . . . 0.0 112.823 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -150.63 49.43 0.87 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.85 0.357 . . . . 0.0 110.941 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -159.31 140.66 12.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.113 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -101.53 -177.69 3.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.339 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.402 ' CD1' ' CD2' ' A' ' 61' ' ' LEU . 3.0 tt -170.02 102.64 0.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.821 0.343 . . . . 0.0 111.493 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 23.4 t -90.04 125.44 42.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.124 178.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.403 ' HB3' HD11 ' A' ' 80' ' ' LEU . 10.0 p90 -145.06 163.36 34.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.864 0.364 . . . . 0.0 111.422 -179.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.35 119.3 9.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.754 179.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.439 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.5 mp -85.07 146.32 6.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.9 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.52 103.7 10.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.88 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.3 mmtp -56.72 -21.93 31.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.212 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -47.44 -36.6 10.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.804 0.335 . . . . 0.0 111.312 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -148.36 20.99 1.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.194 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 48.96 73.59 0.22 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.853 0.359 . . . . 0.0 111.059 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 99.8 m -132.45 147.4 52.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.915 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.01 91.81 3.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.732 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.42 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 4.3 t80 -89.94 121.11 31.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.833 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.428 ' HG ' ' CZ ' ' A' ' 10' ' ' PHE . 3.0 mm? -76.76 176.08 8.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.74 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 60.5 t -145.35 -66.34 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.144 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 -123.39 169.07 11.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.962 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.7 tt -176.11 134.66 0.26 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.901 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.86 -141.43 10.28 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.591 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.3 m -134.61 175.62 9.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.907 0.385 . . . . 0.0 110.883 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -82.08 -32.58 30.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.4 m -78.65 -32.9 47.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.95 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.38 -58.77 3.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.905 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.27 -34.54 77.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.83 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.887 179.942 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.862 0.363 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 63.32 139.01 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.912 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.36 -174.9 0.57 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.824 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -133.98 120.99 37.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.121 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -115.02 163.84 15.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.737 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.5 p -128.28 155.44 44.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.041 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.412 ' OG ' ' CE1' ' A' ' 79' ' ' PHE . 14.7 m -99.99 -178.37 3.83 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.984 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -74.16 -46.23 43.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.826 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -29.65 69.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.02 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.424 ' CE2' ' HB3' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -58.28 -38.98 78.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.997 179.975 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -61.86 -33.12 73.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.78 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -89.95 -21.63 22.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.139 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -79.59 -25.94 41.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.155 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.1 mp -88.86 -38.44 14.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.26 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 48.6 pttt -57.86 -30.33 65.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.133 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.417 HD11 HG21 ' A' ' 16' ' ' ILE . 27.9 mm -85.19 -29.15 6.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.161 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.0 mt -81.22 -36.82 29.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.916 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.6 p -60.14 -26.21 35.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.111 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -90.09 -42.98 10.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.545 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.09 -30.88 69.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.534 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 147.87 80.35 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.41 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.437 ' CZ ' ' CD1' ' A' ' 26' ' ' LEU . 8.9 t80 -157.57 171.88 19.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.941 0.401 . . . . 0.0 110.942 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -145.51 169.42 18.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.862 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.7 mp -97.67 -27.75 14.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.08 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -66.34 -34.18 77.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.952 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.437 ' CD1' ' CZ ' ' A' ' 22' ' ' PHE . 3.9 pp -64.79 -34.34 78.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.892 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.41 -41.25 56.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.883 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -72.42 -23.67 61.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.2 mmmt -90.04 -31.68 17.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.333 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.7 p -80.8 -7.4 10.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.865 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.5 t -53.94 -42.02 51.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-O 120.778 0.323 . . . . 0.0 111.125 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.81 -27.0 72.33 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.379 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -87.2 -19.41 28.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.589 0.233 . . . . 0.0 111.159 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.5 mt -77.95 -38.29 45.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.918 0.389 . . . . 0.0 110.983 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.81 -33.03 73.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.244 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 71.2 p -97.87 -31.49 12.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 60.86 58.94 2.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.874 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.456 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -75.35 -56.98 1.77 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.44 -179.876 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 25.0 Cg_endo -62.23 -82.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.063 1.842 . . . . 0.0 112.468 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 46.56 97.36 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.121 0 CA-C-O 120.873 0.368 . . . . 0.0 111.549 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.37 146.86 4.38 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.371 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.16 -25.35 19.14 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.564 2.176 . . . . 0.0 112.461 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.3 -28.12 61.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.166 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.41 ' HB3' ' CD2' ' A' ' 60' ' ' HIS . 58.9 m-85 -112.46 -66.79 1.05 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.156 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.3 tttt 63.06 149.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.867 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -76.33 121.46 23.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.841 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -149.22 163.97 23.03 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.899 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -68.35 161.92 42.72 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.532 2.154 . . . . 0.0 112.208 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.3 mp -95.86 -70.93 0.69 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.03 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.1 mmtt -92.45 171.77 8.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.102 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -102.41 116.05 5.39 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.437 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 109.12 26.87 5.04 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.469 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -163.95 108.03 0.99 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.745 0.307 . . . . 0.0 110.819 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.45 32.29 2.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.968 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -94.72 -32.01 13.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.847 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -108.4 145.3 34.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.884 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -159.02 128.4 5.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.747 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -105.88 136.28 45.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.0 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 32.0 p -129.2 149.61 50.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.682 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.412 ' CE1' HD22 ' A' ' 66' ' ' LEU . 34.3 m-70 -107.12 86.05 2.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.142 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.7 pp -59.22 -41.1 87.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.692 179.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -111.98 167.67 8.79 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.748 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.8 -7.59 21.7 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.464 2.109 . . . . 0.0 112.943 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -148.32 42.37 1.0 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.762 0.315 . . . . 0.0 111.161 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 89.7 mt -154.33 135.63 14.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.906 0.384 . . . . 0.0 111.059 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.412 HD22 ' CE1' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -102.46 171.71 7.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.448 179.7 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.6 tt -165.46 100.3 0.71 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.945 0.402 . . . . 0.0 111.356 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.446 ' O ' ' N ' ' A' ' 81' ' ' VAL . 33.6 t -96.18 135.44 30.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.034 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -146.0 161.98 38.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.995 0.426 . . . . 0.0 111.35 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -131.47 124.95 31.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.516 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 2.9 mm -84.6 143.85 10.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.344 -179.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.85 87.72 2.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.714 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.7 pttt -57.69 -22.21 44.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.217 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -51.7 -32.21 29.12 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.847 0.356 . . . . 0.0 110.987 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -141.27 15.22 2.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.219 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.0 t30 47.54 69.91 0.47 Allowed 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 120.84 0.352 . . . . 0.0 111.156 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 76.3 m -137.44 146.12 43.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.986 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 34.1 tp -101.0 92.33 4.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.776 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.412 ' CE1' ' OG ' ' A' ' 7' ' ' SER . 4.2 t80 -90.77 114.02 26.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.86 -179.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.424 ' HB3' ' CE2' ' A' ' 10' ' ' PHE . 2.6 mt -71.48 178.96 3.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.928 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.446 ' N ' ' O ' ' A' ' 68' ' ' VAL . 58.7 t -139.13 -70.85 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.105 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -129.99 171.49 12.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.975 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.7 tt -174.9 152.66 1.56 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.872 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 125.6 -156.99 19.56 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.467 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.3 t -119.99 133.93 55.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.933 0.397 . . . . 0.0 110.885 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -59.76 -47.73 84.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.972 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 25.1 p -64.56 -31.11 72.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.997 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -73.89 -56.51 4.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.3 mp -58.06 -30.78 66.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.981 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.944 179.997 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 tpt . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.91 0.386 . . . . 0.0 111.263 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -98.56 146.92 25.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.85 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -177.4 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.908 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -128.7 106.28 14.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.12 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -103.07 160.97 14.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.803 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.7 p -139.18 151.47 46.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.026 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 16.7 p -109.3 -168.57 1.35 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.821 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.0 -60.01 2.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.924 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.3 mttt -59.91 -33.36 71.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.906 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CE1' ' HB3' ' A' ' 80' ' ' LEU . 75.1 t80 -59.46 -53.5 57.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.935 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.34 -29.96 69.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.028 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -83.47 -6.92 59.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.456 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -89.99 -29.76 18.23 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.689 0.281 . . . . 0.0 111.061 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 pp -84.46 -38.39 20.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.071 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -59.19 -22.15 60.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.228 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.0 mm -88.98 -29.29 5.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.309 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.9 mt -79.79 -32.71 40.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.119 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.5 p -61.97 -30.83 49.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.141 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.65 -37.44 35.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.939 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -77.85 -31.33 51.44 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.869 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 145.58 80.17 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.526 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -153.48 161.16 42.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.831 0.348 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -107.96 172.58 6.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.905 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -99.47 -57.85 2.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.975 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -60.82 -21.5 63.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.053 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -52.73 -54.07 38.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.881 0.372 . . . . 0.0 111.044 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 tt -61.02 -46.32 91.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.827 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -60.65 -25.09 66.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.998 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.68 -29.43 22.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.001 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 25.6 t -67.76 -24.55 30.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.309 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 32.1 m -48.02 -38.95 8.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.852 0.358 . . . . 0.0 111.38 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.23 -27.9 65.98 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.456 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -90.12 -22.45 21.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.662 0.268 . . . . 0.0 111.15 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.3 mt -69.33 -33.08 72.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.833 0.349 . . . . 0.0 110.93 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.75 -32.96 60.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.136 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.0 p -88.67 -46.24 9.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 62.03 55.61 2.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.861 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -93.86 -53.19 0.25 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.225 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -84.63 -88.89 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.49 2.126 . . . . 0.0 112.588 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.57 35.88 26.06 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.889 0.376 . . . . 0.0 111.134 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 60.14 109.4 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.069 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.82 -25.98 38.85 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.365 2.044 . . . . 0.0 112.414 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.3 pttt -66.78 -31.12 71.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.006 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -103.74 -39.3 6.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.933 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.5 mttm 63.61 127.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.879 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -61.39 146.57 47.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.017 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -160.13 150.7 15.38 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.826 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.04 -78.71 0.01 OUTLIER 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.5 2.133 . . . . 0.0 112.36 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.87 -73.96 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.89 0.376 . . . . 0.0 110.914 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.2 mttm -157.42 114.42 3.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.879 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 64.73 -117.26 10.16 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.523 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.15 -140.46 0.16 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.484 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 13.1 mt 60.7 101.65 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.853 0.358 . . . . 0.0 110.827 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.0 mttp -109.16 -22.61 12.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.172 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.3 -32.93 67.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.949 0.404 . . . . 0.0 110.759 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -105.31 118.2 35.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.758 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 23.4 mtp180 -142.63 155.07 44.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.018 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -129.79 143.14 50.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.839 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 21.1 m -134.94 177.43 7.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.837 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -130.18 83.4 2.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.958 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.92 -34.75 65.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.916 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 12.8 mmtt -117.92 163.72 23.2 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.681 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.8 -19.29 30.6 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.654 2.236 . . . . 0.0 112.467 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -148.66 76.38 1.35 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.711 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -175.57 122.13 0.2 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.139 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -89.95 157.03 18.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.2 179.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.6 tt -153.16 98.35 2.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.902 0.382 . . . . 0.0 111.391 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 34.8 t -94.09 134.1 32.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.284 179.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.45 ' CD1' ' CD1' ' A' ' 71' ' ' ILE . 5.1 p90 -146.26 158.28 43.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.996 0.427 . . . . 0.0 111.312 -179.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -135.24 109.35 8.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.637 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.45 ' CD1' ' CD1' ' A' ' 69' ' ' TYR . 1.5 mp -84.97 141.22 14.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.837 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.69 103.54 10.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.72 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm -59.98 -19.71 53.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.417 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -30.34 36.4 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.747 0.308 . . . . 0.0 111.142 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -148.57 19.71 1.04 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.339 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 46.98 75.3 0.13 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.751 0.31 . . . . 0.0 111.283 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 96.6 m -133.99 148.48 51.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.942 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.56 91.46 3.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.66 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 6.1 t80 -89.93 110.96 21.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.92 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.427 ' HB3' ' CE1' ' A' ' 10' ' ' PHE . 3.4 mm? -70.41 -178.01 1.62 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.603 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 82.5 t -152.47 -72.42 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.304 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.08 163.85 11.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.914 0.387 . . . . 0.0 111.096 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -177.09 87.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.926 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 177.7 -136.61 3.1 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.512 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -140.32 147.86 40.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.744 0.307 . . . . 0.0 110.895 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -59.2 -39.8 83.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.062 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.1 t -75.42 -37.49 60.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.976 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.1 -57.82 5.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.922 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -64.78 -62.28 1.66 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.856 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.958 179.949 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 ptp . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 120.863 0.363 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -156.76 140.16 15.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.869 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.32 -175.72 2.0 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.793 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.1 mp -130.31 124.18 57.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.003 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -117.2 162.84 17.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.801 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 44.1 p -126.12 153.67 44.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.951 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.7 t -102.87 177.12 4.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.021 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.7 mtmm -74.02 -43.89 56.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.861 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.7 mmtm -79.07 -28.21 43.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.934 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.417 ' CE2' HD12 ' A' ' 80' ' ' LEU . 31.7 t80 -55.83 -34.33 65.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.978 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -68.12 -31.69 71.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.867 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -78.63 -22.02 47.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.166 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.04 -27.34 33.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.107 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.416 HD12 ' CE2' ' A' ' 10' ' ' PHE . 4.8 mt -81.11 -37.77 28.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.106 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 15.7 ptmt -57.47 -28.85 63.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.129 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.9 mm -78.74 -28.72 14.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.328 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 26.5 mt -87.48 -40.68 14.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.115 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.5 p -57.62 -32.17 41.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.2 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt -77.54 -31.17 53.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.935 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -100.37 29.89 4.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.917 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.16 98.44 0.54 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.539 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -176.88 97.86 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.82 0.343 . . . . 0.0 110.932 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -68.83 160.87 29.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.889 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -94.21 -31.0 14.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.894 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.73 -34.86 73.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.977 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.2 pp -61.15 -35.68 77.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.869 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.5 tp -77.07 -29.48 55.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.972 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -79.49 -25.54 41.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.069 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.34 -32.06 17.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.088 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -71.39 -14.32 17.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.582 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.3 m -51.73 -46.35 38.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.841 0.353 . . . . 0.0 111.365 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.65 -26.39 68.41 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.413 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -88.71 -19.59 25.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.637 0.256 . . . . 0.0 111.162 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.7 mt -72.23 -45.93 58.2 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.842 0.353 . . . . 0.0 111.012 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.83 -30.59 71.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.23 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 73.5 p -92.38 -35.61 13.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.899 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.423 ' HA ' HD22 ' A' ' 40' ' ' LEU . 17.8 mt-10 60.01 61.59 1.84 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.874 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.46 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 2.5 mt-30 -79.94 -56.67 0.73 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.564 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.46 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 36.5 Cg_endo -66.27 -86.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.029 1.819 . . . . 0.0 112.327 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.423 HD22 ' HA ' ' A' ' 37' ' ' GLU . 3.6 mm? 44.63 92.64 0.01 OUTLIER 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.775 0.321 . . . . 0.0 111.625 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.404 ' CB ' ' HD2' ' A' ' 42' ' ' PRO . . . -59.33 165.63 3.69 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.404 ' HD2' ' CB ' ' A' ' 41' ' ' ALA . 11.2 Cg_endo -54.6 -68.95 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.522 2.148 . . . . 0.0 112.196 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.04 -30.65 71.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.753 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -108.56 55.08 0.64 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.693 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.96 -162.22 0.94 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.766 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -113.2 155.2 25.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.869 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 11.3 p-80 -165.6 145.42 5.5 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.825 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -73.03 159.51 47.69 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.597 2.198 . . . . 0.0 112.298 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.82 -44.97 10.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.893 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.2 mtmp? 62.86 142.67 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.866 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 110.98 35.78 1.94 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.4 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 101.76 -35.11 5.14 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.442 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -91.14 52.79 2.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.861 0.362 . . . . 0.0 110.832 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.0 mttm -60.07 -34.69 73.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.855 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -65.82 -40.05 91.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.865 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.402 ' CD1' ' HB2' ' A' ' 70' ' ' GLN . 10.1 m-85 -64.85 157.93 26.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.9 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.2 mtt85 -166.84 137.37 3.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.846 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -109.68 130.66 55.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.904 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.2 p -144.64 175.35 10.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.839 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 55.9 m-70 -129.36 93.06 3.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.838 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.5 -34.56 72.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.906 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.28 164.99 13.52 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.677 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.61 -12.69 34.86 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.508 2.139 . . . . 0.0 112.81 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -149.91 65.38 0.98 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.953 0.406 . . . . 0.0 110.967 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -163.88 159.29 20.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.853 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -116.72 169.77 9.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.831 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.6 tp -170.01 94.91 0.26 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.031 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.536 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 39.2 t -99.49 69.65 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.897 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -89.52 172.89 8.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.057 0.456 . . . . 0.0 111.487 -179.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.402 ' HB2' ' CD1' ' A' ' 56' ' ' PHE . 22.0 tt0 -142.72 141.06 31.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.641 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 2.8 mm -84.79 147.91 5.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.357 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.402 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -122.28 87.81 2.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.616 179.522 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.8 mmtt -53.01 -23.87 8.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.388 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -47.18 -33.12 4.95 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.194 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -149.07 20.45 0.98 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.193 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.8 m120 47.29 67.8 0.74 Allowed 'General case' 0 C--O 1.231 0.106 0 CA-C-O 120.848 0.356 . . . . 0.0 111.261 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.402 ' HB ' ' CG ' ' A' ' 72' ' ' LYS . 16.0 m -133.96 150.82 51.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.05 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.1 tt -102.34 100.6 10.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.407 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 2.6 t80 -93.77 112.7 24.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.017 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.417 HD12 ' CE2' ' A' ' 10' ' ' PHE . 23.1 mt -67.39 175.18 2.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.712 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.536 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 73.2 t -149.39 -85.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.414 -179.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.7 mtt85 -99.0 162.51 13.03 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.917 0.389 . . . . 0.0 111.059 -179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 tt -176.5 127.48 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.87 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 154.87 -166.5 32.46 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.437 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.8 m -118.3 145.56 44.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.854 0.359 . . . . 0.0 110.903 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 13.2 p80 -62.22 -34.54 76.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.9 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.88 -34.08 77.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.909 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -79.61 -63.98 1.29 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.942 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.5 mp -61.08 -74.75 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.829 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.931 -179.975 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.896 0.379 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.7 mp -145.36 154.73 42.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.825 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.96 -177.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.802 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.4 mp -132.14 107.36 12.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.167 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -105.28 167.63 9.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.654 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.8 p -135.87 157.65 46.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.172 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.438 ' HB3' ' CE1' ' A' ' 79' ' ' PHE . 59.8 p -113.86 -176.57 2.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.04 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.9 mmmt -71.16 -58.41 3.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.848 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 26.4 mttp -58.38 -30.36 66.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.876 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.415 ' CZ ' HD12 ' A' ' 80' ' ' LEU . 93.3 t80 -58.66 -33.72 70.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -66.71 -43.19 84.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.954 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.1 mttt -74.36 -20.12 60.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.237 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.47 -27.31 24.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.181 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.89 -36.74 19.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.117 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -58.51 -29.06 65.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.209 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.47 HD11 HG22 ' A' ' 16' ' ' ILE . 30.2 mm -81.46 -29.16 10.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.285 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 24.3 mt -82.11 -39.94 22.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.076 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.8 p -58.19 -30.44 39.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.163 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.86 -28.99 25.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.932 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -98.45 31.19 2.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.833 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.21 90.57 0.93 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.524 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.406 ' CZ ' HD13 ' A' ' 26' ' ' LEU . 11.1 t80 -175.43 93.76 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.821 0.343 . . . . 0.0 110.863 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -69.81 167.12 17.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.849 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -92.1 -31.01 15.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.962 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.83 -34.61 73.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.406 HD13 ' CZ ' ' A' ' 22' ' ' PHE . 3.9 pp -60.12 -35.51 75.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.938 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.75 -29.71 68.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.897 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -82.27 -28.83 31.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.956 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.2 -32.83 19.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.037 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.7 p -68.25 -21.33 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.418 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.0 p -48.43 -29.29 2.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.437 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.02 -29.35 72.4 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.458 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -89.99 -26.74 20.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.687 0.279 . . . . 0.0 110.956 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 65.8 mt -63.92 -42.77 97.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.943 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.75 -35.98 70.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.067 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.0 p -76.67 -46.61 24.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.89 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 59.34 48.84 9.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.919 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.417 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 2.1 mt-30 -90.27 -52.1 0.33 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.195 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.417 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 73.6 Cg_endo -83.36 -92.77 0.0 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.381 2.054 . . . . 0.0 112.823 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 53.82 28.95 8.96 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-O 120.801 0.334 . . . . 0.0 111.025 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 66.66 140.77 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.001 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.38 -40.65 2.93 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.511 2.141 . . . . 0.0 112.563 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.431 ' HG3' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -54.09 -42.06 68.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.114 -179.754 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.431 ' CE1' ' HG3' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -146.17 72.21 1.28 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.947 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.4 mttt -56.63 -79.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.984 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.1 t0 -178.4 140.28 0.2 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.752 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 16.9 p-80 -146.54 145.16 22.43 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -74.89 176.67 9.56 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.499 2.133 . . . . 0.0 112.365 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.1 mt -117.74 -175.62 2.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.82 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.81 167.17 30.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.941 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.64 -54.39 0.79 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.343 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.64 36.35 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.549 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -137.89 -64.38 0.54 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.769 0.319 . . . . 0.0 110.876 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.6 mtmm 61.09 33.71 19.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.939 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -138.09 -45.7 0.52 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.878 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -60.29 150.98 28.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.92 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 -161.91 142.91 10.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.742 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -125.82 140.31 52.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.145 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.6 p -144.31 160.29 41.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.804 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -108.31 82.19 1.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.985 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.9 pp -59.76 -33.24 71.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.823 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.427 ' CB ' ' HD2' ' A' ' 63' ' ' PRO . 1.0 OUTLIER -110.72 170.36 5.37 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.643 179.845 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.427 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 43.4 Cg_endo -68.43 -8.6 23.53 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.431 2.087 . . . . 0.0 112.893 -179.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -158.49 58.79 0.45 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.865 0.364 . . . . 0.0 111.038 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.4 mp -151.9 150.84 30.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.054 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -119.22 106.78 12.68 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.501 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 40.0 tp -96.28 97.26 9.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.95 0.405 . . . . 0.0 111.479 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.496 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 27.6 t -94.85 123.73 47.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.062 178.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.477 ' CD1' ' CD1' ' A' ' 71' ' ' ILE . 2.4 p90 -140.8 177.71 7.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.915 0.388 . . . . 0.0 111.285 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.83 106.49 4.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.643 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.477 ' CD1' ' CD1' ' A' ' 69' ' ' TYR . 1.5 mp -84.96 137.85 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.896 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.01 101.72 8.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.568 179.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.6 ptpp? -60.19 -20.72 59.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.279 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.65 -32.01 49.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.838 0.352 . . . . 0.0 111.025 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -145.21 17.14 1.54 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.273 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 21.2 m120 46.92 74.46 0.15 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.789 0.328 . . . . 0.0 111.336 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.6 m -134.08 139.48 45.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.925 0.393 . . . . 0.0 110.955 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.06 94.36 5.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.639 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.438 ' CE1' ' HB3' ' A' ' 7' ' ' SER . 3.4 t80 -92.2 112.88 24.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.986 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.415 HD12 ' CZ ' ' A' ' 10' ' ' PHE . 16.1 mt -71.66 171.07 12.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.707 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.496 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 92.7 t -147.65 -65.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.084 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -115.73 166.03 12.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.06 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -178.92 119.73 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.885 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.63 -168.53 26.3 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.449 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.1 t -100.32 172.59 7.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.852 0.358 . . . . 0.0 110.972 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -79.04 -40.46 31.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.857 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.7 m -74.26 -31.35 62.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.871 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.15 -31.86 70.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.85 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -76.19 -75.33 0.19 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.785 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.922 -179.977 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 mtm . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.84 0.353 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 mt -132.42 132.88 43.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.19 -175.47 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.763 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -132.04 118.13 35.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.073 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -111.79 168.65 9.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.896 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.6 p -143.45 148.41 36.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.999 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.422 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 6.9 p -109.81 -171.1 1.77 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.903 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm -79.78 -33.92 40.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.668 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -80.5 -26.45 38.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.934 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.429 ' CZ ' HD11 ' A' ' 80' ' ' LEU . 35.9 t80 -72.01 -30.63 65.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.934 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.12 -39.38 49.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.128 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.2 ptmm? -75.74 -13.14 60.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.421 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -90.11 -32.33 16.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.686 0.279 . . . . 0.0 111.056 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tp -79.48 -40.17 30.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.165 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -57.4 -23.28 48.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.234 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.9 mm -86.05 -29.86 6.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.172 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mt -85.96 -34.02 20.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.934 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.3 p -60.42 -34.91 59.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.1 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.03 -46.09 58.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.844 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -73.15 -30.9 63.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.928 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 146.91 84.91 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.41 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.426 ' CZ ' HD12 ' A' ' 26' ' ' LEU . 8.3 t80 -164.66 99.11 0.79 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.712 0.291 . . . . 0.0 110.882 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.73 166.22 11.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.843 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.3 mp -98.04 -29.99 12.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.859 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.7 -32.64 74.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.957 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.426 HD12 ' CZ ' ' A' ' 22' ' ' PHE . 4.0 pp -59.6 -31.69 69.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.855 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.97 -26.66 66.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.066 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 32.3 m-85 -79.76 -26.83 40.57 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.058 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.72 -29.64 19.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.16 -179.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.8 p -74.25 -25.56 19.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.213 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.6 p -49.03 -29.36 2.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.333 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -67.57 -29.11 73.68 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.342 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -89.99 -32.77 16.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.911 0.386 . . . . 0.0 110.958 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 40.6 mt -68.08 -41.64 81.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.833 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.07 -40.02 94.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.118 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 68.3 p -75.67 -36.68 60.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.876 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 59.8 52.54 5.36 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.863 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -96.42 -52.82 0.22 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.595 -179.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -81.78 -82.57 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.383 2.055 . . . . 0.0 113.238 -179.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 48.69 40.72 16.43 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.895 0.378 . . . . 0.0 111.136 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.69 132.66 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.085 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -74.24 -25.26 13.72 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.497 2.131 . . . . 0.0 112.451 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.31 -28.34 38.23 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.071 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.41 ' HB3' ' CD2' ' A' ' 60' ' ' HIS . 14.6 m-85 -103.19 -61.5 1.4 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.026 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.9 140.38 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.839 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -59.7 151.17 25.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.909 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -162.76 146.65 8.97 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.9 157.16 51.89 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.462 2.108 . . . . 0.0 112.366 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.23 -46.44 11.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.839 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 60.81 30.5 19.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.904 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -82.75 -52.46 3.88 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.539 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.73 -40.04 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.504 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.404 HD11 ' CE1' ' A' ' 56' ' ' PHE . 1.3 mt -75.77 -32.97 60.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.799 0.333 . . . . 0.0 110.864 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 43.4 mttp 58.54 22.54 9.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.142 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -119.03 -34.96 3.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.973 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.404 ' CE1' HD11 ' A' ' 53' ' ' LEU . 10.9 m-85 -66.0 176.01 1.83 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.009 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -177.41 130.57 0.16 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.65 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -103.23 137.98 40.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.985 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 15.1 m -141.97 -176.29 4.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.83 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.41 ' CD2' ' HB3' ' A' ' 44' ' ' TYR . 23.4 m-70 -143.26 93.76 2.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.914 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.66 -29.55 65.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.902 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -121.69 162.77 34.83 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.809 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.69 -12.76 32.94 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.602 2.202 . . . . 0.0 112.772 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -148.75 65.7 1.05 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.83 0.348 . . . . 0.0 111.254 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -163.25 149.61 12.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.025 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -115.86 149.01 39.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.633 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -149.66 93.32 2.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.131 -179.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.506 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 38.7 t -95.37 69.4 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.968 0.413 . . . . 0.0 110.794 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.424 ' CE1' HD12 ' A' ' 71' ' ' ILE . 9.9 p90 -89.64 168.64 11.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.457 -179.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -137.64 141.13 41.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.692 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.436 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.4 mp -108.79 119.67 58.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.792 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.23 99.21 11.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.655 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.3 mttp -60.73 -28.1 68.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.359 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -52.87 -28.36 22.7 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.836 0.351 . . . . 0.0 111.149 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -139.7 10.94 2.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.558 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 46.82 76.14 0.11 Allowed 'General case' 0 N--CA 1.461 0.1 0 CA-C-O 120.838 0.351 . . . . 0.0 111.335 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 54.8 m -139.85 150.21 44.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.933 0.397 . . . . 0.0 111.036 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.0 tp -107.14 93.84 4.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.434 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.422 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 4.3 t80 -89.87 107.33 19.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.841 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.429 HD11 ' CZ ' ' A' ' 10' ' ' PHE . 1.9 mt -71.36 173.93 7.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.96 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.506 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 90.5 t -151.92 -84.55 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.203 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 34.8 ttt180 -83.42 163.28 20.65 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.949 0.404 . . . . 0.0 110.771 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.421 HD12 ' CE2' ' A' ' 22' ' ' PHE . 1.3 tm? -175.49 95.12 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.889 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 144.25 -168.67 26.56 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.622 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.9 t -112.96 159.41 19.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.756 0.312 . . . . 0.0 110.97 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -62.43 -39.34 93.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.909 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 23.6 m -71.4 -33.22 69.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.921 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.33 -48.12 65.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.884 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.7 mp -59.3 -29.3 67.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.023 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.248 0.984 0 CA-C-O 118.171 -0.919 . . . . 0.0 110.956 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.616 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.795 0.331 . . . . 0.0 110.922 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.53 -174.5 0.55 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.872 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -130.27 114.66 29.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.992 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.65 164.49 11.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.795 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 32.7 p -134.76 151.3 50.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.943 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.411 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 8.1 t -105.29 -169.52 1.61 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.07 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.0 mtmt -81.59 -56.44 4.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.887 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.2 mtmt -58.85 -30.76 67.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.825 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -63.62 -46.52 85.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.777 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -58.73 -30.8 67.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.963 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.13 -6.04 59.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.55 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.96 -49.67 6.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.817 0.341 . . . . 0.0 111.194 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.468 HD12 HD22 ' A' ' 83' ' ' LEU . 1.3 tp -59.43 -38.3 80.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.338 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.2 ptpp? -56.96 -26.46 59.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.316 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 29.1 mm -85.19 -28.56 6.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.375 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.682 HD11 ' HA2' ' A' ' 84' ' ' GLY . 7.1 mt -86.29 -32.47 21.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.138 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 p -64.49 -31.59 54.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.06 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.14 -40.2 38.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.932 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -77.64 -39.01 46.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.943 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 156.89 89.4 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.479 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -154.56 168.1 27.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.819 0.342 . . . . 0.0 110.876 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -122.01 155.31 35.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.946 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.4 mp -83.77 -50.86 7.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.982 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.2 ttmm -65.02 -21.05 66.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.123 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.595 ' O ' HD13 ' A' ' 26' ' ' LEU . 3.2 tm? -52.85 -43.06 65.78 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.079 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.518 ' O ' HG12 ' A' ' 30' ' ' VAL . 5.8 tp -64.23 -54.24 36.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.866 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.616 ' O ' HG12 ' A' ' 31' ' ' VAL . 14.4 m-85 -62.96 -18.27 62.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.953 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -90.07 -36.99 14.57 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.185 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.518 HG12 ' O ' ' A' ' 27' ' ' LEU . 9.5 p -71.8 -20.99 20.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.451 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.616 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.5 p -49.35 -40.52 14.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.368 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.406 ' N ' HG13 ' A' ' 31' ' ' VAL . . . -59.91 -28.62 66.29 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.354 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -89.98 -22.62 21.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.791 0.329 . . . . 0.0 111.096 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.5 mt -74.5 -35.86 63.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.854 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.05 -31.33 62.83 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.282 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 65.9 p -94.43 -34.7 12.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.937 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.914 ' HA ' HD21 ' A' ' 40' ' ' LEU . 3.2 mt-10 60.1 62.17 1.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.739 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.55 -51.68 0.23 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.857 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -80.49 -80.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.337 2.025 . . . . 0.0 113.349 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.914 HD21 ' HA ' ' A' ' 37' ' ' GLU . 2.0 mm? 46.67 27.95 0.73 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.633 0.254 . . . . 0.0 111.432 -179.511 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.89 ' HB3' ' HB2' ' A' ' 44' ' ' TYR . . . 59.54 117.25 0.02 OUTLIER Pre-proline 0 CA--C 1.53 0.193 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.232 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -52.99 -41.92 68.09 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.461 2.107 . . . . 0.0 112.589 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.12 -26.76 60.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.32 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.89 ' HB2' ' HB3' ' A' ' 41' ' ' ALA . 3.5 m-85 -87.85 -66.42 0.92 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.839 0.352 . . . . 0.0 110.988 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.01 117.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.2 p-10 -56.1 157.25 4.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.061 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -162.01 155.18 17.42 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.949 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo . . . . . 0 C--N 1.345 0.353 0 C-N-CA 122.528 2.152 . . . . 0.0 112.286 179.995 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 56' ' ' PHE . 4.0 m-20 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.888 0.375 . . . . 0.0 110.908 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.424 ' CD2' ' O ' ' A' ' 55' ' ' ASP . 67.8 m-85 -157.05 122.88 4.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.851 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -143.41 139.89 30.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.719 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.481 ' HG3' HG22 ' A' ' 68' ' ' VAL . 10.8 tt0 -121.51 143.09 49.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.987 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.76 ' HB2' HD12 ' A' ' 40' ' ' LEU . 31.8 p -131.28 -174.33 3.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.693 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.445 ' CE1' HD23 ' A' ' 66' ' ' LEU . 34.8 m-70 -143.14 90.49 2.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.987 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.648 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.1 pp -59.64 -41.28 90.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.721 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.648 ' N ' HD12 ' A' ' 61' ' ' LEU . 0.5 OUTLIER -101.61 166.05 12.94 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.832 179.867 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.0 -11.86 32.9 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.561 2.174 . . . . 0.0 112.594 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.52 ' O ' HD12 ' A' ' 65' ' ' LEU . 0.8 OUTLIER -145.57 48.18 1.26 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.8 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.52 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.1 OUTLIER -156.68 132.19 9.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.168 -179.85 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.621 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -99.03 177.81 5.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.247 179.48 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.491 HD23 ' C ' ' A' ' 67' ' ' LEU . 5.7 tt -166.37 99.11 0.6 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.899 0.38 . . . . 0.0 111.403 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.481 HG22 ' HG3' ' A' ' 58' ' ' GLU . 16.4 t -90.0 136.41 23.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.115 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.879 ' HA ' HG23 ' A' ' 81' ' ' VAL . 7.3 p90 -153.03 169.69 22.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.925 0.393 . . . . 0.0 111.447 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -140.01 123.58 17.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.68 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.513 ' N ' HD13 ' A' ' 71' ' ' ILE . 2.9 mm -84.82 150.28 4.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.329 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.425 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -134.48 87.06 2.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.76 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -21.14 43.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.213 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -50.85 -31.34 16.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.753 0.311 . . . . 0.0 111.021 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -144.0 17.48 1.76 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.201 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 47.99 71.91 0.31 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.809 0.337 . . . . 0.0 111.286 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.425 ' HB ' ' CG ' ' A' ' 72' ' ' LYS . 55.4 m -138.21 145.77 41.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.022 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.616 ' HB2' HD12 ' A' ' 2' ' ' LEU . 1.0 OUTLIER -105.2 95.15 5.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.669 179.794 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.411 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.1 t80 -92.16 115.68 28.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.014 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.406 ' O ' ' CE1' ' A' ' 79' ' ' PHE . 20.0 mt -76.19 168.3 20.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.673 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.879 HG23 ' HA ' ' A' ' 69' ' ' TYR . 48.0 t -131.85 -68.94 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.086 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -128.16 167.06 17.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.951 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.468 HD22 HD12 ' A' ' 14' ' ' LEU . 9.7 tt -171.9 134.75 0.79 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.834 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.682 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 143.28 -149.51 21.44 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.581 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.8 150.08 48.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.818 0.342 . . . . 0.0 110.804 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -59.99 -43.36 95.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.824 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.7 p -70.82 -32.96 70.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.92 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.49 -56.59 6.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.861 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.0 mp . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.856 179.987 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.448 HD23 ' HB3' ' A' ' 76' ' ' ASN . 1.4 mt . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.851 0.357 . . . . 0.0 110.76 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.507 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -60.13 -176.47 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.829 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.444 ' N ' HD12 ' A' ' 4' ' ' ILE . 4.3 mp -128.5 113.93 31.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.171 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.425 ' O ' HD12 ' A' ' 80' ' ' LEU . 4.3 mm-40 -114.29 165.83 12.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.763 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 63.0 p -132.57 162.42 31.33 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.023 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.418 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 1.0 OUTLIER -118.64 -176.53 3.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.918 -179.948 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.68 -47.36 32.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.856 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.9 mttt -67.52 -34.56 77.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.857 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.53 ' CE2' HD13 ' A' ' 80' ' ' LEU . 60.9 t80 -63.22 -31.22 72.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -69.29 -53.38 20.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.91 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -13.33 61.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.318 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.426 ' OD2' HD21 ' A' ' 89' ' ' LEU . 0.7 OUTLIER -82.15 -29.2 31.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.774 0.321 . . . . 0.0 110.998 -179.956 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.58 -31.71 63.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.983 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.411 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -62.71 -26.48 68.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.058 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.1 mm -81.48 -29.74 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.21 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.696 HD21 ' HA2' ' A' ' 84' ' ' GLY . 3.3 mm? -84.51 -36.25 22.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.081 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.411 HG12 ' HA ' ' A' ' 15' ' ' LYS . 11.8 p -63.81 -33.75 63.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.133 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.7 tptt -71.23 -36.35 71.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -87.6 -24.25 24.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.961 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 138.3 94.69 0.32 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.354 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.836 ' CE1' HD11 ' A' ' 26' ' ' LEU . 50.5 t80 -167.64 125.56 1.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.82 0.343 . . . . 0.0 110.988 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.479 ' C ' HD22 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -94.95 -176.44 3.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.7 -179.98 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.507 ' N ' HD22 ' A' ' 24' ' ' LEU . 3.5 mm? -111.73 -32.14 6.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.95 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.57 -29.87 68.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.957 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.836 HD11 ' CE1' ' A' ' 22' ' ' PHE . 4.2 pp -72.9 -31.33 64.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.992 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.616 HD12 ' CZ ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -72.67 -26.48 61.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.023 179.976 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.497 ' O ' HG12 ' A' ' 31' ' ' VAL . 6.7 m-85 -86.3 -29.31 23.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.897 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.19 -32.53 19.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.969 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.6 p -62.21 -18.56 20.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.267 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.497 HG12 ' O ' ' A' ' 28' ' ' TYR . 11.6 p -50.97 -43.41 25.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.755 0.312 . . . . 0.0 111.26 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.463 ' N ' HG13 ' A' ' 31' ' ' VAL . . . -59.19 -28.12 63.71 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.355 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.7 m-20 -89.96 -24.26 21.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.796 0.331 . . . . 0.0 111.006 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 68.4 mt -72.51 -34.01 67.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.942 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.96 -39.06 30.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.232 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.0 p -83.88 -38.99 20.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.886 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.749 ' HB3' HD11 ' A' ' 40' ' ' LEU . 8.4 mt-10 59.71 66.69 0.96 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.925 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.403 ' CB ' ' HD3' ' A' ' 39' ' ' PRO . 0.5 OUTLIER -94.56 -53.11 0.24 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.16 -179.912 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.403 ' HD3' ' CB ' ' A' ' 38' ' ' GLN . 60.8 Cg_endo -85.82 -88.97 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.611 2.207 . . . . 0.0 112.81 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.749 HD11 ' HB3' ' A' ' 37' ' ' GLU . 0.4 OUTLIER 59.32 21.25 9.49 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.67 0.272 . . . . 0.0 111.038 -179.898 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.642 ' HB1' ' HE3' ' A' ' 43' ' ' LYS . . . 63.31 128.73 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.002 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.17 -23.55 21.08 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.426 2.084 . . . . 0.0 112.476 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.642 ' HE3' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.35 -30.63 42.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.069 -179.954 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -101.56 -58.04 1.96 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.077 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.7 mttt 62.52 149.64 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.883 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -92.13 161.47 14.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.87 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -159.25 158.73 28.64 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.914 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.45 ' HA ' ' HB3' ' A' ' 57' ' ' ARG . 68.2 Cg_endo . . . . . 0 C--N 1.344 0.323 0 C-N-CA 122.654 2.236 . . . . 0.0 112.787 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.801 0.334 . . . . 0.0 110.833 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -84.86 138.79 32.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.868 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.45 ' HB3' ' HA ' ' A' ' 48' ' ' PRO . 0.5 OUTLIER -156.73 155.21 31.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.887 -179.934 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.547 ' HB2' HG22 ' A' ' 68' ' ' VAL . 33.3 tt0 -130.15 133.87 46.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.972 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 28.9 p -119.09 -172.04 2.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.798 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.1 m80 -140.5 79.9 1.73 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.887 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.504 ' CD2' HD12 ' A' ' 67' ' ' LEU . 1.1 pp -55.91 -50.63 70.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.866 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.489 ' N ' HD12 ' A' ' 61' ' ' LEU . 6.7 mttt -95.15 167.69 12.43 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.705 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 38.2 Cg_endo -66.66 -12.78 37.25 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.545 2.163 . . . . 0.0 112.604 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.855 ' O ' HD12 ' A' ' 65' ' ' LEU . 5.9 t70 -150.92 51.74 0.86 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.677 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.855 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.4 OUTLIER -156.5 130.47 8.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.065 -179.823 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.467 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -104.21 160.92 14.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.295 179.555 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.504 HD12 ' CD2' ' A' ' 61' ' ' LEU . 5.1 tt -148.78 102.62 3.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.854 0.359 . . . . 0.0 111.344 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.547 HG22 ' HB2' ' A' ' 58' ' ' GLU . 25.7 t -90.01 128.78 41.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.231 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.804 ' HA ' HG23 ' A' ' 81' ' ' VAL . 12.1 p90 -150.08 165.94 31.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.909 0.385 . . . . 0.0 111.13 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -145.95 124.38 12.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.858 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.569 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -90.39 151.85 3.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.893 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.414 ' HB2' ' CG ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -120.62 104.0 9.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.733 179.758 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.76 -24.53 64.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.374 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.414 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 1.5 pt20 -53.22 -33.9 54.81 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.089 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -142.95 15.5 1.92 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.444 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.448 ' HB3' HD23 ' A' ' 2' ' ' LEU . 6.9 m-20 46.12 74.32 0.15 Allowed 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.78 0.324 . . . . 0.0 111.332 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.507 HG23 ' HB ' ' A' ' 3' ' ' THR . 98.8 m -136.08 140.34 43.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.933 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.512 HD21 ' CD2' ' A' ' 69' ' ' TYR . 0.6 OUTLIER -95.82 90.51 5.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.686 179.919 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.418 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 2.9 t80 -90.0 106.94 18.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.916 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.53 HD13 ' CE2' ' A' ' 10' ' ' PHE . 3.4 mt -64.53 169.46 4.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.767 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.804 HG23 ' HA ' ' A' ' 69' ' ' TYR . 42.5 t -131.86 -69.81 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.174 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.8 mmm-85 -132.98 178.57 6.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.847 0.356 . . . . 0.0 111.101 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.41 HD12 ' HG ' ' A' ' 67' ' ' LEU . 7.7 tt -177.89 144.34 0.35 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.93 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.696 ' HA2' HD21 ' A' ' 17' ' ' LEU . . . 139.72 -131.72 5.28 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.576 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 39.3 t -147.98 147.12 29.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.769 0.319 . . . . 0.0 110.938 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -59.69 -30.95 69.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.838 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.2 m -78.87 -37.04 41.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.87 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -68.52 -55.43 11.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.854 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.426 HD21 ' OD2' ' A' ' 13' ' ' ASP . 4.3 mp . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.622 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.795 0.331 . . . . 0.0 110.838 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.493 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -57.73 -177.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.039 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.9 mp -131.64 130.43 62.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.055 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -121.57 165.94 14.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.803 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 43.1 p -127.43 160.14 32.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.026 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.421 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 0.5 OUTLIER -117.32 -176.37 2.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.912 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 ptpt -76.78 -47.14 22.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.857 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.7 mtpt -67.96 -31.18 70.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.775 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.709 ' CE1' HD23 ' A' ' 14' ' ' LEU . 56.2 t80 -59.65 -39.36 84.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.87 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.85 -34.51 78.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.939 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 mttm -78.54 -24.73 45.5 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.158 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.556 ' OD1' HD11 ' A' ' 89' ' ' LEU . 3.8 m-20 -87.72 -28.58 21.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.109 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.709 HD23 ' CE1' ' A' ' 10' ' ' PHE . 0.1 OUTLIER -80.37 -28.41 38.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.14 -179.832 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 11.8 pttt -70.83 -28.53 64.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.267 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 28.4 mm -83.21 -45.17 18.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.312 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.545 HD12 HD13 ' A' ' 83' ' ' LEU . 5.4 mt -63.07 -40.35 97.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.012 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.433 HG12 ' O ' ' A' ' 14' ' ' LEU . 11.7 p -64.27 -29.85 48.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.106 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -77.33 -37.51 52.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.903 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -82.24 -49.25 10.3 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.899 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 170.26 89.44 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.486 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.848 ' CE1' HD11 ' A' ' 26' ' ' LEU . 56.0 t80 -174.34 151.69 1.65 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.859 0.362 . . . . 0.0 110.856 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -126.7 159.2 34.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.908 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -89.46 -29.42 19.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.005 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -58.31 -41.49 84.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.896 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.848 HD11 ' CE1' ' A' ' 22' ' ' PHE . 3.9 pp -66.45 -31.34 72.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.861 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.526 ' HA ' HG12 ' A' ' 30' ' ' VAL . 5.3 tt -66.77 -28.37 68.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.041 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.549 ' O ' HG12 ' A' ' 31' ' ' VAL . 0.3 OUTLIER -78.84 -30.05 45.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.939 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -84.28 -35.58 23.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.065 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.526 HG12 ' HA ' ' A' ' 27' ' ' LEU . 14.6 p -69.63 -11.95 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.499 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.549 HG12 ' O ' ' A' ' 28' ' ' TYR . 11.7 p -50.83 -41.57 21.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.858 0.361 . . . . 0.0 111.261 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.418 ' N ' HG13 ' A' ' 31' ' ' VAL . . . -69.68 -28.37 72.23 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.297 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -84.66 -19.91 32.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.715 0.293 . . . . 0.0 111.21 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.524 HD21 ' CD2' ' A' ' 61' ' ' LEU . 79.3 mt -70.88 -45.38 64.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.798 0.332 . . . . 0.0 110.956 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.22 -50.17 66.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.242 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.8 p -75.26 -37.05 61.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.928 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 61.09 54.69 3.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.903 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.451 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 3.5 mt-30 -79.42 -52.59 1.13 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.31 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.451 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 56.0 Cg_endo -73.09 -88.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.065 1.843 . . . . 0.0 112.544 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.0 mp 51.95 -178.49 0.02 OUTLIER 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.758 0.313 . . . . 0.0 111.077 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.4 ' HB3' ' CD2' ' A' ' 44' ' ' TYR . . . -122.17 114.74 30.54 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.161 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.13 71.1 2.27 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.5 2.133 . . . . 0.0 112.299 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.4 ' HD3' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -168.75 -41.0 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.959 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.423 ' HB2' ' CG ' ' A' ' 60' ' ' HIS . 16.2 m-85 -85.54 5.47 31.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.42 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp 62.52 145.98 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.888 0.375 . . . . 0.0 110.978 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -156.04 109.3 2.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.874 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.439 ' CG ' ' HD2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -169.8 167.01 5.31 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.744 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.439 ' HD2' ' CG ' ' A' ' 47' ' ' HIS . 43.1 Cg_endo . . . . . 0 C--N 1.345 0.358 0 C-N-CA 122.514 2.143 . . . . 0.0 112.306 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.701 0.286 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -69.28 133.09 47.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.009 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 21.4 mtp180 -150.75 150.83 31.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.743 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -139.17 120.87 15.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.883 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.1 p -127.82 150.78 49.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.875 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.423 ' CG ' ' HB2' ' A' ' 44' ' ' TYR . 10.8 m-70 -102.44 78.43 1.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.999 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.728 HD12 ' HG2' ' A' ' 62' ' ' LYS . 2.2 pp -58.99 -33.25 70.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.974 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.728 ' HG2' HD12 ' A' ' 61' ' ' LEU . 1.1 mmmm -127.61 159.66 64.78 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.713 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.54 122.71 12.12 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.649 2.232 . . . . 0.0 112.273 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 61.7 39.85 13.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.971 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -138.36 104.04 5.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.914 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.688 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -95.72 123.28 39.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.554 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.967 HD21 HD12 ' A' ' 80' ' ' LEU . 7.9 tt -117.82 99.51 6.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.945 0.402 . . . . 0.0 111.168 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.561 HG23 ' HB3' ' A' ' 82' ' ' ARG . 16.3 t -89.79 138.68 18.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.081 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.628 ' HA ' HG23 ' A' ' 81' ' ' VAL . 40.0 p90 -147.09 -178.07 6.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.086 0.469 . . . . 0.0 111.57 -179.39 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -162.1 111.45 1.49 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.574 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.542 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -84.7 146.62 6.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.058 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.06 103.95 11.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.742 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.08 -22.21 26.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.328 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -47.49 -36.65 10.54 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.289 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -148.26 21.03 1.08 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.268 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 26.4 m-20 48.27 71.92 0.31 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.914 0.387 . . . . 0.0 111.117 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.493 HG23 ' HB ' ' A' ' 3' ' ' THR . 99.7 m -128.71 147.54 50.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.911 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.622 ' HB2' HD12 ' A' ' 2' ' ' LEU . 0.7 OUTLIER -102.5 92.63 4.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.727 179.844 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.421 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 2.1 t80 -91.19 102.7 15.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.872 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.967 HD12 HD21 ' A' ' 67' ' ' LEU . 3.6 mm? -63.65 167.21 6.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.716 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.628 HG23 ' HA ' ' A' ' 69' ' ' TYR . 59.3 t -137.92 -66.62 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.971 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.561 ' HB3' HG23 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -114.39 163.34 15.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.974 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.766 HD23 HD12 ' A' ' 67' ' ' LEU . 3.1 tm? -176.38 91.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.826 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.688 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 172.53 -152.29 16.31 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.667 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.3 t -127.0 141.71 51.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.856 0.36 . . . . 0.0 110.805 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -59.39 -30.16 68.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.891 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.15 -31.47 30.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.906 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -69.12 -48.86 61.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.923 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.556 HD11 ' OD1' ' A' ' 13' ' ' ASP . 3.6 mp . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.882 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.529 HD23 ' HA ' ' A' ' 76' ' ' ASN . 2.6 mp . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.769 0.318 . . . . 0.0 110.823 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.465 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -59.45 -177.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.836 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.9 mp -128.76 123.01 58.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.039 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -121.05 166.02 14.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.79 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 41.3 p -134.4 150.72 50.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.985 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.414 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 2.6 t -105.49 178.32 4.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.005 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.21 -47.11 65.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.807 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -68.46 -31.94 71.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.742 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.539 ' CZ ' HD13 ' A' ' 80' ' ' LEU . 85.2 t80 -64.02 -41.84 97.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.892 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -60.3 -52.71 64.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.935 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.2 ptmt -69.71 -12.41 61.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.26 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.659 ' OD1' HD21 ' A' ' 89' ' ' LEU . 1.8 m-20 -90.05 -24.22 21.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.247 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.925 HD23 HD11 ' A' ' 24' ' ' LEU . 1.2 tp -89.97 -44.68 9.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.384 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.455 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -53.51 -24.64 13.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.413 -179.571 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 29.4 mm -80.67 -28.88 11.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.223 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.71 HD11 ' HA2' ' A' ' 84' ' ' GLY . 25.3 mt -87.06 -38.4 16.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.071 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.545 HG23 ' HA ' ' A' ' 23' ' ' ASP . 12.1 p -59.05 -40.32 80.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.04 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -30.0 69.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.836 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -100.64 28.26 5.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.888 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.68 102.79 0.55 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.673 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.405 ' HB3' ' HA ' ' A' ' 18' ' ' VAL . 53.5 t80 -175.67 -40.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.713 0.292 . . . . 0.0 110.878 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.545 ' HA ' HG23 ' A' ' 18' ' ' VAL . 0.5 OUTLIER 59.41 173.9 0.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.912 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.925 HD11 HD23 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -117.86 17.05 14.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.081 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.02 -33.54 16.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.875 0.369 . . . . 0.0 110.871 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.78 HD12 ' N ' ' A' ' 27' ' ' LEU . 4.3 pp -64.66 -29.62 70.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.977 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.78 ' N ' HD12 ' A' ' 26' ' ' LEU . 3.3 tp -71.75 -36.36 70.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.903 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.488 ' O ' HG22 ' A' ' 31' ' ' VAL . 5.1 m-85 -76.47 -27.65 56.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.874 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.84 -31.57 20.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.986 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.583 HG12 ' O ' ' A' ' 26' ' ' LEU . 14.7 p -78.36 -5.0 7.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.614 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.488 HG22 ' O ' ' A' ' 28' ' ' TYR . 30.0 m -53.03 -42.91 46.41 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-O 120.89 0.376 . . . . 0.0 111.361 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.434 ' N ' HG23 ' A' ' 31' ' ' VAL . . . -63.85 -26.98 70.52 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.432 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.2 m-20 -85.61 -22.4 28.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.632 0.253 . . . . 0.0 111.129 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 75.2 mt -76.54 -48.64 18.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.902 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.09 -36.02 82.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.213 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.5 p -88.16 -42.69 12.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.985 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.629 ' HA ' HD11 ' A' ' 40' ' ' LEU . 15.4 mt-10 61.88 57.29 2.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.876 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -88.72 -51.89 0.38 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.412 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -79.95 -92.93 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.221 1.947 . . . . 0.0 112.703 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.629 HD11 ' HA ' ' A' ' 37' ' ' GLU . 1.0 OUTLIER 55.86 -178.24 0.04 OUTLIER 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.826 0.346 . . . . 0.0 111.074 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.544 ' HB3' ' HD2' ' A' ' 44' ' ' TYR . . . -128.32 106.46 19.47 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.04 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.97 -7.14 20.76 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.425 2.083 . . . . 0.0 112.793 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.2 32.0 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.697 0.284 . . . . 0.0 111.013 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.544 ' HD2' ' HB3' ' A' ' 41' ' ' ALA . 18.1 m-85 -139.95 -79.66 0.3 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.932 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -177.98 37.67 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.922 0.391 . . . . 0.0 110.893 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.405 ' O ' ' CG ' ' A' ' 47' ' ' HIS . 43.3 p-10 -71.99 75.14 0.92 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.876 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.405 ' CG ' ' O ' ' A' ' 46' ' ' ASP . 1.4 m-70 -178.16 170.0 0.89 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.905 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo . . . . . 0 C--N 1.346 0.425 0 C-N-CA 122.599 2.199 . . . . 0.0 112.231 179.98 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.864 0.364 . . . . 0.0 110.72 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -80.61 129.32 34.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.855 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -148.22 133.31 18.26 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.728 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.555 ' HG3' HG22 ' A' ' 68' ' ' VAL . 3.8 tt0 -109.76 146.37 35.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.97 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 21.2 m -149.69 141.95 24.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.772 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.533 ' CE1' HD23 ' A' ' 66' ' ' LEU . 10.0 m-70 -101.97 92.72 4.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.008 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.596 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.0 pp -62.2 -39.88 94.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.755 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.612 ' HD3' HD13 ' A' ' 65' ' ' LEU . 4.1 mttp -104.53 169.14 7.54 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.741 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 56.8 Cg_endo -71.1 -7.91 22.41 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.559 2.172 . . . . 0.0 112.95 -179.7 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.712 ' C ' HD12 ' A' ' 65' ' ' LEU . 1.1 m-20 -150.6 45.01 0.86 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.864 0.364 . . . . 0.0 111.156 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.712 HD12 ' C ' ' A' ' 64' ' ' ASP . 5.3 mp -158.91 130.21 6.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.152 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.673 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -94.24 -179.41 4.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.28 179.532 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.833 HD21 HD23 ' A' ' 80' ' ' LEU . 6.4 tt -170.09 102.24 0.29 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.836 0.35 . . . . 0.0 111.383 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.555 HG22 ' HG3' ' A' ' 58' ' ' GLU . 22.8 t -95.23 137.33 23.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.444 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.617 ' HA ' HG23 ' A' ' 81' ' ' VAL . 6.1 p90 -147.05 170.55 16.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.982 0.42 . . . . 0.0 111.405 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -143.03 114.2 7.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.553 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.488 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.4 mp -84.89 135.52 24.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.933 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.98 103.79 12.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.85 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.77 -19.85 62.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.153 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -51.65 -36.51 46.45 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.861 0.362 . . . . 0.0 111.042 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -144.99 18.56 1.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.193 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.529 ' HA ' HD23 ' A' ' 2' ' ' LEU . 12.8 m120 47.27 77.24 0.09 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.829 0.347 . . . . 0.0 111.188 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.465 HG23 ' HB ' ' A' ' 3' ' ' THR . 63.7 m -137.39 144.04 42.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.102 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.47 HD13 HD11 ' A' ' 71' ' ' ILE . 38.1 tp -98.61 91.09 4.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.451 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.414 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.1 t80 -89.8 105.82 18.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.888 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.833 HD23 HD21 ' A' ' 67' ' ' LEU . 3.0 mt -64.75 169.26 5.22 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.774 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.617 HG23 ' HA ' ' A' ' 69' ' ' TYR . 74.7 t -136.8 -71.48 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.086 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -118.67 168.44 10.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.932 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.452 HD22 HD12 ' A' ' 14' ' ' LEU . 5.5 tt -176.61 117.37 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.923 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.71 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 158.14 -147.86 16.32 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.497 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.8 136.89 29.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.821 0.343 . . . . 0.0 110.917 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.38 -30.4 66.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.909 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.7 p -76.75 -30.77 56.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.859 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -80.27 -54.84 5.36 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.927 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.659 HD21 ' OD1' ' A' ' 13' ' ' ASP . 4.5 mp . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.772 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.5 mp . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.759 0.314 . . . . 0.0 110.926 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.663 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -68.76 -173.41 0.46 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.792 179.986 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.0 mp -130.2 136.76 57.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.075 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -139.63 161.09 38.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.753 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.6 p -135.36 155.43 50.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.082 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 8.7 p -110.89 -168.7 1.34 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.795 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -81.14 -42.47 20.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.942 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 71.0 mttt -72.25 -41.05 67.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.892 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.808 ' CE1' HD21 ' A' ' 14' ' ' LEU . 14.2 t80 -59.86 -34.39 73.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.805 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -65.61 -31.12 71.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.6 mtpp -87.36 -8.04 57.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.389 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.608 ' CG ' HD21 ' A' ' 89' ' ' LEU . 3.8 m-20 -88.98 -29.48 19.48 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.792 0.329 . . . . 0.0 111.128 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.808 HD21 ' CE1' ' A' ' 10' ' ' PHE . 21.9 mt -84.08 -35.3 23.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.076 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.402 ' HE3' HD11 ' A' ' 16' ' ' ILE . 27.7 pttt -58.7 -29.85 66.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.172 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.402 HD11 ' HE3' ' A' ' 15' ' ' LYS . 29.3 mm -79.89 -39.16 19.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.282 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.57 ' CD2' HD21 ' A' ' 65' ' ' LEU . 3.6 mp -72.31 -41.04 67.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.014 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.407 HG12 ' O ' ' A' ' 14' ' ' LEU . 13.6 p -63.74 -30.14 49.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.232 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -76.55 -33.9 58.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.824 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -83.15 -59.27 2.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.765 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -170.07 63.11 0.17 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.378 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.42 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 1.3 t80 -151.21 172.09 16.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.81 0.338 . . . . 0.0 110.89 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -151.42 144.1 24.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.826 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.0 mp -71.25 -23.78 62.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.043 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -51.73 68.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.073 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.42 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 2.4 pp -58.75 -31.75 68.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.007 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.508 ' HA ' HG12 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -63.24 -31.24 72.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.894 179.914 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -80.72 -26.65 37.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.7 mtpp -87.57 -29.41 21.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.973 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.508 HG12 ' HA ' ' A' ' 27' ' ' LEU . 14.8 p -76.12 -16.88 15.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.471 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.8 t -48.39 -42.06 11.6 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 120.83 0.348 . . . . 0.0 111.356 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.83 -27.5 64.39 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.339 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.9 m-20 -85.32 -22.44 28.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.819 0.343 . . . . 0.0 111.039 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.6 mt -74.26 -33.4 63.28 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.85 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.88 -43.27 62.72 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.087 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 73.3 p -86.26 -39.29 16.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.87 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 60.85 67.96 0.78 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.846 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.93 -53.57 0.26 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.255 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -82.82 -86.58 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 122.287 1.991 . . . . 0.0 112.545 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.45 ' N ' HD12 ' A' ' 40' ' ' LEU . 6.8 mp 55.38 39.44 31.2 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.786 0.327 . . . . 0.0 111.148 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 60.54 100.31 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.206 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.35 62.24 2.73 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.465 2.11 . . . . 0.0 112.404 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.12 -44.6 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.967 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -82.33 -29.68 30.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.9 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.3 mmpp? 62.08 118.7 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.032 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -81.94 154.73 25.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.716 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 12.3 p80 177.09 156.72 0.46 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.869 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo . . . . . 0 C--N 1.343 0.266 0 C-N-CA 122.621 2.214 . . . . 0.0 112.419 179.974 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.861 0.362 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.514 ' CE2' HG21 ' A' ' 81' ' ' VAL . 1.8 m-85 -80.72 174.42 11.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.827 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -175.53 125.73 0.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.837 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -116.03 130.56 56.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.782 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.65 ' SG ' HD23 ' A' ' 67' ' ' LEU . 28.5 p -134.3 -175.68 3.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.971 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 78.9 m80 -134.67 80.37 1.85 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.014 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.808 HD23 HD22 ' A' ' 67' ' ' LEU . 3.3 pp -57.34 -31.24 65.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.122 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.414 ' HB2' HD12 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -135.6 151.63 74.78 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.984 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -51.81 133.31 44.84 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.522 2.148 . . . . 0.0 112.34 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 59.41 25.55 14.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.011 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.57 HD21 ' CD2' ' A' ' 17' ' ' LEU . 3.3 mp -134.35 117.28 16.19 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.787 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.71 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.1 OUTLIER -90.03 179.35 5.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.717 -179.968 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.966 HD11 HD12 ' A' ' 80' ' ' LEU . 37.8 tp -167.39 100.35 0.51 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.372 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' A' ' 81' ' ' VAL . 41.4 t -95.3 123.33 47.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.893 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.421 ' HA ' HG23 ' A' ' 81' ' ' VAL . 10.3 p90 -138.78 159.5 41.97 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.976 0.417 . . . . 0.0 111.463 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -136.96 118.28 14.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.519 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.489 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.4 mp -84.94 123.63 39.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.921 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.401 ' CD ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -97.03 100.52 12.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.699 179.703 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.89 -22.62 38.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.112 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -49.57 -36.06 22.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.844 0.354 . . . . 0.0 111.049 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -145.39 18.29 1.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.257 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 47.23 71.01 0.35 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.804 0.335 . . . . 0.0 111.217 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.663 HG23 ' HB ' ' A' ' 3' ' ' THR . 97.6 m -130.19 148.68 52.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.065 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.418 ' CD1' HD11 ' A' ' 71' ' ' ILE . 65.0 tp -102.13 90.5 3.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.541 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.432 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 3.5 t80 -89.93 115.77 27.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.017 -179.635 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.966 HD12 HD11 ' A' ' 67' ' ' LEU . 3.3 mm? -68.97 168.14 14.35 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.706 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.514 HG21 ' CE2' ' A' ' 56' ' ' PHE . 43.9 t -141.0 -58.75 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.98 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 41.5 mmm-85 -131.54 165.49 23.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.842 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.873 HD12 HD13 ' A' ' 67' ' ' LEU . 5.9 tt -177.05 139.1 0.26 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.948 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.71 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 118.85 -143.35 17.39 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.59 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.9 t -127.4 147.74 50.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.806 0.336 . . . . 0.0 110.861 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -59.3 -30.78 68.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.915 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.3 m -87.22 -31.52 20.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -67.7 -31.4 71.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.9 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.608 HD21 ' CG ' ' A' ' 13' ' ' ASP . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.506 ' N ' HD12 ' A' ' 2' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.746 0.308 . . . . 0.0 111.008 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.481 HG22 ' H ' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -56.81 -170.45 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.863 179.872 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.481 ' H ' HG22 ' A' ' 3' ' ' THR . 4.0 mp -130.97 136.22 58.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.89 0.376 . . . . 0.0 111.187 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -128.31 170.05 13.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.644 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.6 p -137.68 165.66 25.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.854 0.359 . . . . 0.0 111.075 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.3 -175.3 3.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.913 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.13 -53.08 13.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.964 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -62.41 -36.29 81.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.913 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -59.56 -33.17 71.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.93 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -70.57 -40.6 73.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.849 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.1 mttt -78.31 -4.94 50.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.337 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.488 ' OD1' HD11 ' A' ' 89' ' ' LEU . 1.6 m-20 -90.08 -56.54 3.18 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.829 0.347 . . . . 0.0 111.173 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -54.67 -36.8 65.0 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.224 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.8 ptpt -58.9 -30.29 67.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.998 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.1 mm -82.58 -30.48 9.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.249 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.429 HD11 ' HA2' ' A' ' 84' ' ' GLY . 69.5 mt -81.78 -39.5 24.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.949 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.7 p -59.74 -33.47 52.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.08 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.1 tttp -78.88 -30.06 44.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.991 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -98.33 29.07 3.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.93 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.09 95.42 0.89 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.603 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.685 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 15.6 t80 -176.66 101.52 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.837 0.351 . . . . 0.0 110.956 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.598 ' C ' HD22 ' A' ' 24' ' ' LEU . 1.9 t0 -60.2 -167.87 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.863 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.598 HD22 ' C ' ' A' ' 23' ' ' ASP . 3.8 mm? -118.7 -39.92 2.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.997 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.3 mttp -66.67 -27.06 67.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.181 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.89 ' O ' HG23 ' A' ' 30' ' ' VAL . 3.9 pp -57.92 -41.85 83.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.045 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.725 ' O ' HG13 ' A' ' 31' ' ' VAL . 2.8 tp -64.46 -30.05 71.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.038 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.655 ' O ' HG22 ' A' ' 31' ' ' VAL . 17.7 m-85 -73.37 -27.63 61.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.144 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.86 -30.63 18.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.054 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.89 HG23 ' O ' ' A' ' 26' ' ' LEU . 34.8 t -75.01 -18.06 16.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.384 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.725 HG13 ' O ' ' A' ' 27' ' ' LEU . 28.1 m -49.47 -27.97 3.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.828 0.347 . . . . 0.0 111.441 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.555 ' O ' HG23 ' A' ' 36' ' ' THR . . . -72.34 -27.39 69.92 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.606 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -86.97 -28.53 22.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.759 0.314 . . . . 0.0 111.077 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.477 HD22 HD13 ' A' ' 67' ' ' LEU . 36.3 mt -65.11 -44.61 88.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.981 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.84 -35.96 67.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.32 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.555 HG23 ' O ' ' A' ' 32' ' ' GLY . 78.0 p -77.24 -45.12 27.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.887 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.516 ' HB3' HD11 ' A' ' 40' ' ' LEU . 18.5 mt-10 60.81 55.97 3.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.794 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.409 ' N ' ' CD ' ' A' ' 39' ' ' PRO . 0.1 OUTLIER -91.72 -52.22 0.29 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.097 -179.799 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.409 ' CD ' ' N ' ' A' ' 38' ' ' GLN . 47.2 Cg_endo -83.48 -78.31 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.422 2.081 . . . . 0.0 112.736 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.593 HD22 ' HB2' ' A' ' 59' ' ' CYS . 0.9 OUTLIER 57.7 24.75 10.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.728 0.299 . . . . 0.0 111.01 -179.89 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.24 138.52 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.096 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.71 -20.88 15.1 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.583 2.189 . . . . 0.0 112.538 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.442 ' HG2' ' CD2' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -97.67 31.58 2.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.11 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.442 ' CD2' ' HG2' ' A' ' 43' ' ' LYS . 72.5 m-85 -157.92 -70.88 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.066 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 5.9 mmmt 63.55 139.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.933 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -73.58 161.94 29.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.939 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -165.08 154.26 11.23 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.867 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo . . . . . 0 C--N 1.344 0.29 0 C-N-CA 122.57 2.18 . . . . 0.0 112.324 179.962 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.802 0.334 . . . . 0.0 110.842 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -87.68 147.92 25.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.765 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -160.79 147.0 14.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.95 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.631 ' OE2' HD22 ' A' ' 66' ' ' LEU . 54.0 tt0 -127.48 117.63 22.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.933 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.593 ' HB2' HD22 ' A' ' 40' ' ' LEU . 30.3 p -115.02 177.48 4.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.843 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -124.05 90.05 3.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.893 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.882 HD23 HD12 ' A' ' 67' ' ' LEU . 3.8 pp -65.82 -32.43 73.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.883 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.511 ' HB2' HD12 ' A' ' 61' ' ' LEU . 1.4 mttp -139.16 165.18 33.89 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.809 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -62.01 130.58 31.38 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.54 2.16 . . . . 0.0 112.153 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 61.14 31.03 19.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.839 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -140.14 118.16 11.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.812 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.7 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -97.6 177.64 5.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.616 179.916 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.96 HD21 HD12 ' A' ' 80' ' ' LEU . 3.9 tt -165.37 102.35 0.73 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.12 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.409 ' O ' ' N ' ' A' ' 81' ' ' VAL . 37.5 t -94.65 124.16 47.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.167 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.653 ' HD2' HD22 ' A' ' 67' ' ' LEU . 5.6 p90 -141.18 157.94 44.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.933 0.397 . . . . 0.0 111.244 -179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -137.26 114.04 10.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.75 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.502 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.3 mp -84.98 131.99 32.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.88 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.424 ' HB2' ' CG ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -106.55 102.42 11.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.801 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.1 mttp -59.33 -23.43 62.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.491 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.424 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 1.1 pt20 -51.26 -33.49 28.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.73 0.3 . . . . 0.0 111.141 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -145.51 17.2 1.49 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.482 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 m120 46.53 72.61 0.22 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.894 0.378 . . . . 0.0 111.256 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.411 ' HB ' ' CG ' ' A' ' 72' ' ' LYS . 85.1 m -131.18 142.93 50.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.921 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.435 ' CD1' HD11 ' A' ' 71' ' ' ILE . 64.4 tp -97.06 90.29 5.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.525 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -91.68 106.35 18.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.899 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.96 HD12 HD21 ' A' ' 67' ' ' LEU . 3.6 mm? -65.43 -177.57 0.43 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.675 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.409 ' N ' ' O ' ' A' ' 68' ' ' VAL . 45.6 t -153.25 -62.99 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.165 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -127.54 166.49 17.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.868 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.568 HD12 ' HG ' ' A' ' 67' ' ' LEU . 1.4 tt -178.26 132.6 0.14 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.856 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.7 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 129.76 -145.82 16.8 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.495 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.6 t -129.41 148.23 51.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.845 0.355 . . . . 0.0 110.871 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -64.34 -39.08 93.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 45.2 p -66.43 -31.23 71.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.865 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.68 -53.04 24.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.893 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.488 HD11 ' OD1' ' A' ' 13' ' ' ASP . 3.9 mp . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.881 0.372 . . . . 0.0 110.899 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.584 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -63.73 -178.88 0.33 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.855 -179.951 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.2 mp -131.46 114.58 26.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.116 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -106.57 168.37 9.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.733 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 76.6 p -137.28 148.96 46.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.067 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.417 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 28.9 t -103.55 -167.94 1.44 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.833 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -84.79 -47.75 10.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.803 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -70.51 -28.08 64.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.976 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -56.98 -30.87 64.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.99 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -75.44 -46.81 30.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.926 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.1 mtpp -66.86 -21.91 66.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.173 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.22 -28.67 23.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.817 0.341 . . . . 0.0 111.099 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.557 ' O ' HG12 ' A' ' 18' ' ' VAL . 0.2 OUTLIER -79.28 -34.9 42.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.037 -179.883 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -56.81 -24.53 51.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.228 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.1 mm -80.36 -45.88 21.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.413 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.487 HD21 HD11 ' A' ' 65' ' ' LEU . 3.8 mp -72.65 -44.47 61.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.125 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.557 HG12 ' O ' ' A' ' 14' ' ' LEU . 13.3 p -56.4 -30.04 29.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.224 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.15 -40.19 22.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.997 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -70.59 -62.61 1.32 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.946 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -178.86 75.35 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.51 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.507 ' CE1' HD21 ' A' ' 26' ' ' LEU . 86.0 t80 -153.03 137.51 16.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.805 0.336 . . . . 0.0 110.869 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.24 119.49 39.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.79 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.596 HD23 ' H ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -55.46 -23.67 26.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.182 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.5 tttm -59.2 -50.24 74.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.027 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.507 HD21 ' CE1' ' A' ' 22' ' ' PHE . 2.0 pp -57.86 -28.54 64.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.096 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.527 ' HA ' HG12 ' A' ' 30' ' ' VAL . 4.5 tt -64.88 -26.68 68.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.998 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.683 ' O ' HG12 ' A' ' 31' ' ' VAL . 2.4 m-85 -80.38 -28.09 38.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.172 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -87.53 -29.35 21.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.195 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.527 HG12 ' HA ' ' A' ' 27' ' ' LEU . 15.0 p -75.31 -25.73 18.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.328 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.683 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.5 p -47.23 -32.86 2.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.496 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.36 -26.44 74.56 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.454 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -88.5 -23.78 23.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.759 0.314 . . . . 0.0 111.139 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 34.1 mt -69.34 -38.12 78.0 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.922 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.64 -12.16 59.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.623 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.1 p -107.68 -44.55 4.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.839 0.352 . . . . 0.0 110.99 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.657 ' HB3' HD11 ' A' ' 40' ' ' LEU . 3.0 mt-10 60.8 60.78 1.81 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.697 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.402 ' N ' ' CD ' ' A' ' 39' ' ' PRO . 1.1 mt-30 -91.64 -52.05 0.29 Allowed Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.519 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.402 ' CD ' ' N ' ' A' ' 38' ' ' GLN . 65.4 Cg_endo -80.29 -90.64 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 122.348 2.032 . . . . 0.0 112.988 -179.335 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.657 HD11 ' HB3' ' A' ' 37' ' ' GLU . 0.9 OUTLIER 62.41 -167.54 0.2 Allowed 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.761 0.315 . . . . 0.0 110.716 -179.609 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -112.38 137.41 21.57 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.997 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -73.58 -29.11 11.22 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.526 2.151 . . . . 0.0 112.37 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.71 -29.77 45.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.025 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -97.39 -53.3 3.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.995 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.52 149.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.833 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -97.28 147.31 24.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.86 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -172.82 159.71 3.72 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.953 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo . . . . . 0 C--N 1.344 0.33 0 C-N-CA 122.646 2.231 . . . . 0.0 112.377 -179.996 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.853 0.358 . . . . 0.0 110.719 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -60.27 147.82 38.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.752 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.9 mtt85 -159.28 125.14 4.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.916 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -112.6 108.15 17.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.889 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.5 p -105.36 172.45 6.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.985 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -124.52 83.2 2.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.84 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.76 HD23 HD12 ' A' ' 67' ' ' LEU . 2.2 pp -55.73 -40.78 72.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.032 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.655 ' CG ' HD12 ' A' ' 61' ' ' LEU . 9.1 mmtm -117.54 155.87 49.91 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -48.23 -25.85 7.47 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.733 2.289 . . . . 0.0 112.627 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.679 ' O ' HD12 ' A' ' 65' ' ' LEU . 0.8 OUTLIER -141.04 75.36 1.5 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.816 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.679 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.2 OUTLIER -174.54 119.6 0.23 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.079 -179.85 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.795 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.1 OUTLIER -89.89 151.87 21.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.357 179.708 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.86 HD21 HD23 ' A' ' 80' ' ' LEU . 2.1 tt -145.3 97.58 3.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.919 0.39 . . . . 0.0 111.394 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.546 HG23 ' HB3' ' A' ' 82' ' ' ARG . 37.7 t -92.47 122.0 43.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.785 178.599 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.649 ' HD2' HD22 ' A' ' 67' ' ' LEU . 5.8 p90 -140.38 162.92 34.15 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.996 0.427 . . . . 0.0 111.412 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -144.26 108.08 4.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.575 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.574 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -84.88 133.65 28.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.927 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.35 100.67 10.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.716 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -58.68 -21.77 55.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.343 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -55.0 -29.89 58.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.79 0.329 . . . . 0.0 111.161 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -144.37 16.12 1.67 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.392 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 46.94 72.1 0.27 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.865 0.364 . . . . 0.0 111.251 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.584 HG23 ' HB ' ' A' ' 3' ' ' THR . 99.0 m -134.83 142.51 46.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.946 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.507 HD13 HG23 ' A' ' 31' ' ' VAL . 1.4 tt -99.64 93.11 5.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.726 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 3.6 t80 -92.2 107.62 19.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.877 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.86 HD23 HD21 ' A' ' 67' ' ' LEU . 2.1 mt -67.13 -179.85 1.04 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.563 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.413 ' N ' ' O ' ' A' ' 68' ' ' VAL . 43.9 t -154.25 -56.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.144 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.546 ' HB3' HG23 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -118.81 163.77 16.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.112 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -177.39 101.08 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.849 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.795 ' O ' HD12 ' A' ' 66' ' ' LEU . . . -178.21 169.43 41.17 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.523 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.3 p -95.48 148.81 22.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.8 0.333 . . . . 0.0 110.841 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -68.63 -30.99 69.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.881 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.1 t -70.07 -39.65 75.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.95 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -76.73 -59.04 2.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.882 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.475 HD11 ' HA3' ' A' ' 84' ' ' GLY . 4.4 mp . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.911 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.558 HD13 ' CB ' ' A' ' 78' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.86 0.362 . . . . 0.0 110.908 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.678 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -74.99 -171.14 1.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.013 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.441 ' H ' HG22 ' A' ' 3' ' ' THR . 4.6 mp -137.06 135.89 47.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.042 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -133.58 162.71 31.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.83 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.428 HG22 HD12 ' A' ' 80' ' ' LEU . 41.0 p -138.09 147.82 44.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.988 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -105.44 171.85 7.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.997 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -43.91 87.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.974 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -65.05 -42.65 94.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.885 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.701 ' CE2' HD13 ' A' ' 80' ' ' LEU . 13.3 t80 -59.22 -37.49 77.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.848 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -58.57 -30.49 67.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.825 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.8 mttp -82.11 -23.83 35.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.997 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.496 ' OD2' HD11 ' A' ' 89' ' ' LEU . 1.0 OUTLIER -79.22 -23.81 43.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.159 -179.895 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.59 HD13 ' CE1' ' A' ' 10' ' ' PHE . 2.1 tp -89.96 -39.38 13.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.247 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.3 -30.43 62.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.125 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.9 mm -82.19 -29.26 9.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.128 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.402 HD11 ' HA2' ' A' ' 84' ' ' GLY . 14.1 mt -79.37 -36.94 38.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.015 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.3 p -65.26 -33.99 67.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.058 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -74.13 -31.3 62.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.963 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -87.67 -56.18 3.46 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.904 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -176.83 78.45 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.545 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -158.25 166.77 31.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.795 0.331 . . . . 0.0 110.819 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -130.99 170.95 13.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.928 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.66 -52.37 3.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.916 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.95 -28.91 68.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.974 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.661 ' O ' HD13 ' A' ' 26' ' ' LEU . 3.4 tm? -58.46 -32.52 68.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.893 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.448 ' HA ' HG12 ' A' ' 30' ' ' VAL . 10.0 tt -77.49 -35.45 53.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.101 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.592 ' O ' HG22 ' A' ' 31' ' ' VAL . 6.4 m-85 -76.52 -23.43 53.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.969 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -88.73 -37.45 15.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.879 0.371 . . . . 0.0 111.002 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.448 HG12 ' HA ' ' A' ' 27' ' ' LEU . 12.1 p -66.08 -15.39 18.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.469 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.592 HG22 ' O ' ' A' ' 28' ' ' TYR . 22.5 m -49.25 -39.29 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.13 0 CA-C-O 120.73 0.3 . . . . 0.0 111.325 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.57 -27.3 63.48 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.485 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -89.81 -31.52 17.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.881 0.372 . . . . 0.0 110.91 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' A' ' 31' ' ' VAL . 65.3 mt -62.3 -46.75 87.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.848 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.88 -33.57 74.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.116 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 76.2 p -81.75 -42.27 20.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.987 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.834 ' HB3' HD11 ' A' ' 40' ' ' LEU . 14.2 mt-10 61.62 45.41 8.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.003 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.443 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 2.4 mt-30 -80.83 -52.3 0.89 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.17 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.443 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 50.4 Cg_endo -73.96 -85.5 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.13 1.887 . . . . 0.0 112.659 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.834 HD11 ' HB3' ' A' ' 37' ' ' GLU . 3.8 mt 59.88 22.87 11.88 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.762 0.315 . . . . 0.0 111.233 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 61.71 119.28 0.02 OUTLIER Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.071 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -75.07 59.49 5.25 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.449 2.099 . . . . 0.0 112.428 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.458 ' HG3' ' CE2' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -153.13 -45.22 0.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.93 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.458 ' CE2' ' HG3' ' A' ' 43' ' ' LYS . 14.9 m-85 -97.78 -49.96 4.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.828 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 63.61 126.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.901 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.583 ' HB2' HD13 ' A' ' 40' ' ' LEU . 17.5 t0 -57.97 132.17 52.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.92 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 41.2 p-80 -139.21 148.59 57.74 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.89 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo . . . . . 0 C--N 1.345 0.355 0 C-N-CA 122.485 2.123 . . . . 0.0 112.329 179.92 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.748 0.309 . . . . 0.0 110.881 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -126.1 153.81 43.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.807 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 29.4 mtt85 -164.0 139.56 6.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.906 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.468 ' HG3' HG22 ' A' ' 68' ' ' VAL . 0.7 OUTLIER -124.78 137.52 54.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.861 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.9 p -140.85 171.62 13.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.894 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.43 ' NE2' HD23 ' A' ' 66' ' ' LEU . 12.1 m-70 -115.69 82.32 1.74 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.828 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.549 HD23 ' H ' ' A' ' 61' ' ' LEU . 1.5 pt? -59.77 -30.41 68.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.032 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.441 ' HB3' HD13 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -136.1 149.99 69.85 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.903 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.605 ' O ' HD12 ' A' ' 65' ' ' LEU . 53.1 Cg_exo -52.31 129.17 30.33 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.583 2.189 . . . . 0.0 112.318 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 62.42 29.96 17.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.931 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.605 HD12 ' O ' ' A' ' 63' ' ' PRO . 2.6 mp -139.72 118.32 12.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.925 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.646 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -89.91 173.07 8.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.535 179.815 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.476 HD13 HD12 ' A' ' 83' ' ' LEU . 48.0 tp -164.47 99.34 0.81 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.985 0.421 . . . . 0.0 111.474 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.468 HG22 ' HG3' ' A' ' 58' ' ' GLU . 40.0 t -96.76 124.14 49.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.896 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 7.5 p90 -138.48 155.99 47.94 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.034 0.445 . . . . 0.0 111.409 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -130.58 116.07 17.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.455 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.526 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.4 mp -84.85 128.02 39.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.934 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.409 ' HB2' ' CG ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -102.98 101.65 11.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.672 179.818 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.2 mtmt -58.55 -23.15 57.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.255 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.409 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 1.0 OUTLIER -52.9 -32.44 45.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.818 0.342 . . . . 0.0 111.01 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -145.2 16.48 1.53 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.307 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 45.97 71.76 0.27 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.805 0.336 . . . . 0.0 111.448 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.678 HG23 ' HB ' ' A' ' 3' ' ' THR . 98.5 m -131.4 144.73 51.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.145 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.558 ' CB ' HD13 ' A' ' 2' ' ' LEU . 50.8 tp -101.27 89.66 3.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.41 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -89.98 120.79 31.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.804 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.701 HD13 ' CE2' ' A' ' 10' ' ' PHE . 2.2 mt -69.98 179.76 2.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.738 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.423 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 62.1 t -150.28 -66.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.094 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 -127.2 163.07 24.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.993 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.5 HD23 ' N ' ' A' ' 84' ' ' GLY . 5.2 tt -168.86 152.54 5.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.044 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.646 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 121.82 -168.21 14.55 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.47 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 16.0 t -95.51 171.33 8.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.785 0.326 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -80.56 -30.65 37.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.876 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 91.0 p -85.09 -42.65 14.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.016 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -61.55 -38.73 88.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.84 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.496 HD11 ' OD2' ' A' ' 13' ' ' ASP . 3.7 mm? . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.88 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.805 0.336 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.578 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -60.42 -175.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.865 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -131.1 121.18 48.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.115 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -118.64 167.9 11.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.75 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.471 HG22 ' CE2' ' A' ' 10' ' ' PHE . 59.7 p -142.1 151.1 42.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.963 0.411 . . . . 0.0 110.97 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.407 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 0.3 OUTLIER -112.74 -167.03 1.13 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.98 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.77 -49.32 14.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.856 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.9 mttp -61.22 -31.27 71.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.967 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.616 ' HZ ' HD21 ' A' ' 27' ' ' LEU . 16.2 t80 -71.02 -47.07 60.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.939 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.32 -45.24 94.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.931 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.2 pttt -72.61 -16.04 61.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.375 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -84.43 -29.19 26.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.742 0.306 . . . . 0.0 111.108 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.595 HD23 HD22 ' A' ' 83' ' ' LEU . 9.6 mt -80.24 -36.47 34.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.071 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.8 pttt -58.67 -25.69 63.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.137 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.1 mm -85.13 -29.51 6.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.277 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.753 HD11 ' HA2' ' A' ' 84' ' ' GLY . 7.1 mt -82.89 -37.13 24.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.05 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.4 p -58.21 -30.4 39.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.051 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -30.75 34.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.916 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -98.76 31.04 3.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.86 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.01 94.3 0.75 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.571 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.736 ' CE1' HD11 ' A' ' 26' ' ' LEU . 16.1 t80 -175.13 100.61 0.08 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.737 0.303 . . . . 0.0 110.868 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.22 -177.51 0.53 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.905 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 40.3 mt -110.78 -31.32 7.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.963 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.26 -27.85 66.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.06 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.736 HD11 ' CE1' ' A' ' 22' ' ' PHE . 4.2 pp -57.17 -43.74 82.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.038 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.715 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -59.08 -48.25 82.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.974 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.639 ' O ' HG22 ' A' ' 31' ' ' VAL . 14.6 m-85 -62.23 -20.12 63.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.081 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -88.32 -29.96 19.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.999 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 26' ' ' LEU . 34.0 t -81.97 -26.36 9.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.28 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.676 HG13 ' O ' ' A' ' 27' ' ' LEU . 28.1 m -54.26 -31.65 22.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.285 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.24 -32.17 83.22 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.419 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -90.01 -28.4 19.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.673 0.273 . . . . 0.0 110.85 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 72.1 mt -62.23 -39.73 93.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.898 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.37 -41.13 85.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.103 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.3 p -77.85 -36.61 49.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.893 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.82 ' HA ' HD11 ' A' ' 40' ' ' LEU . 51.2 mt-10 61.25 43.71 10.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.053 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.401 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -92.83 -52.67 0.26 Allowed Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.211 -179.898 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.401 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 72.6 Cg_endo -84.12 -91.57 0.0 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.548 2.165 . . . . 0.0 112.783 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.82 HD11 ' HA ' ' A' ' 37' ' ' GLU . 1.3 mt 57.87 36.27 26.17 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.83 0.348 . . . . 0.0 110.876 -179.731 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 64.0 132.97 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.026 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -77.87 -1.16 11.34 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.571 2.181 . . . . 0.0 112.825 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.441 ' HG2' ' CD2' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -109.51 16.79 22.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.35 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.441 ' CD2' ' HG2' ' A' ' 43' ' ' LYS . 43.6 m-85 -146.49 -65.9 0.29 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.85 0.357 . . . . 0.0 110.871 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.1 mtpp 62.6 121.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.912 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -57.96 143.77 41.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.991 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.448 ' CG ' ' HD2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -154.61 156.33 31.44 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.797 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.448 ' HD2' ' CG ' ' A' ' 47' ' ' HIS . 43.1 Cg_endo . . . . . 0 C--N 1.344 0.342 0 C-N-CA 122.577 2.184 . . . . 0.0 112.332 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 . . . . . 0 N--CA 1.457 -0.104 0 CA-C-O 120.877 0.37 . . . . 0.0 110.802 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -88.42 153.65 21.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.982 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -164.04 147.08 9.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.712 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.529 ' HG3' HG22 ' A' ' 68' ' ' VAL . 4.1 tt0 -131.45 134.2 45.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.993 0.425 . . . . 0.0 111.151 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 25.0 p -125.46 -175.25 3.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.645 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -135.85 81.7 1.9 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.21 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.557 HD23 ' H ' ' A' ' 61' ' ' LEU . 1.3 pt? -59.93 -33.35 71.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.797 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.617 ' CB ' HD12 ' A' ' 65' ' ' LEU . 0.5 OUTLIER -113.6 141.57 26.21 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.341 179.74 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.401 ' HD2' ' HG3' ' A' ' 62' ' ' LYS . 9.4 Cg_endo -52.38 -20.46 11.62 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.651 2.234 . . . . 0.0 112.784 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.603 ' O ' HD23 ' A' ' 65' ' ' LEU . 0.6 OUTLIER -130.25 36.75 3.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.193 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.617 HD12 ' CB ' ' A' ' 62' ' ' LYS . 56.1 mt -151.82 164.86 36.15 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.944 0.402 . . . . 0.0 111.201 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.676 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -126.28 179.81 5.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.125 179.516 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 1.075 HD21 HD12 ' A' ' 80' ' ' LEU . 9.2 tt -170.03 102.92 0.3 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.822 0.344 . . . . 0.0 111.301 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.529 HG22 ' HG3' ' A' ' 58' ' ' GLU . 21.8 t -89.78 138.19 19.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.312 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.6 ' HA ' HG23 ' A' ' 81' ' ' VAL . 14.8 p90 -147.04 177.15 9.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.074 0.464 . . . . 0.0 111.344 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -148.0 123.04 10.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.474 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.525 ' N ' HD13 ' A' ' 71' ' ' ILE . 3.0 mm -84.69 138.41 19.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.342 -179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.412 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -122.77 87.63 2.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.657 179.8 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -22.11 21.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.177 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -46.73 -33.53 4.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.2 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -147.2 20.04 1.23 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.318 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 29.7 m120 48.21 69.33 0.56 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.872 0.368 . . . . 0.0 111.232 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.578 HG23 ' HB ' ' A' ' 3' ' ' THR . 52.2 m -135.1 137.68 43.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.966 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 35.9 tp -94.53 93.22 7.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.591 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.407 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.8 t80 -89.89 111.78 22.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.834 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 1.075 HD12 HD21 ' A' ' 67' ' ' LEU . 3.5 mm? -71.96 171.53 11.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.88 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.6 HG23 ' HA ' ' A' ' 69' ' ' TYR . 66.0 t -137.61 -72.72 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.162 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.0 mmm-85 -116.19 170.56 8.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.922 0.391 . . . . 0.0 111.047 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.872 HD12 HD12 ' A' ' 67' ' ' LEU . 9.4 tt -177.62 135.16 0.18 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.771 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.753 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 146.38 -168.68 27.78 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.558 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -96.47 144.24 26.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.816 0.341 . . . . 0.0 110.812 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -35.41 73.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.948 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 31.9 m -77.01 -47.1 21.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.96 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.46 -51.04 71.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.955 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.863 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.67 HD22 HD12 ' A' ' 78' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.46 0.048 0 CA-C-O 120.815 0.341 . . . . 0.0 110.867 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.448 HG22 ' H ' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -120.4 -171.89 2.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.89 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.448 ' H ' HG22 ' A' ' 3' ' ' THR . 4.3 mp -130.76 126.72 60.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.165 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -124.73 166.49 16.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.846 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 71.3 p -142.0 159.68 41.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.962 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -125.49 172.49 9.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.98 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -44.71 96.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.965 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.6 mttm -62.93 -31.25 72.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.769 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.44 ' CZ ' HD13 ' A' ' 14' ' ' LEU . 76.4 t80 -67.94 -34.88 77.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.839 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -69.77 -30.12 67.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.041 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.85 -21.07 55.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.259 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.744 ' OD1' HD21 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -87.44 -46.36 9.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.807 0.337 . . . . 0.0 111.036 -179.854 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.44 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 1.4 tp -63.43 -37.62 87.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.079 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.3 ptpt -57.44 -22.95 46.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.269 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 26.9 mm -85.88 -36.65 10.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.312 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.835 HD11 ' HA2' ' A' ' 84' ' ' GLY . 63.8 mt -78.58 -35.54 45.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.152 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.0 p -58.16 -33.28 46.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.144 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt -74.87 -30.47 61.33 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.921 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -102.38 30.02 4.84 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.856 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.74 92.53 1.01 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.548 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -176.76 94.96 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.796 0.331 . . . . 0.0 110.861 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.12 -179.06 0.7 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.887 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.2 mp -108.08 -31.74 7.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.851 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.42 -26.03 63.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.042 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.644 ' O ' HG23 ' A' ' 30' ' ' VAL . 3.9 pp -56.6 -38.3 71.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.132 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.662 HD21 HD11 ' A' ' 80' ' ' LEU . 4.4 tt -64.1 -37.35 87.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.918 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.656 ' O ' HG12 ' A' ' 31' ' ' VAL . 0.2 OUTLIER -59.63 -27.0 65.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.031 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.68 -31.67 20.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.885 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 26' ' ' LEU . 24.6 t -67.07 -21.76 28.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.342 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.656 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.2 p -49.98 -29.35 5.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.286 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -71.1 -38.54 63.59 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.46 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -79.81 -26.15 40.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.804 0.335 . . . . 0.0 110.911 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.592 ' HG ' HG12 ' A' ' 30' ' ' VAL . 77.6 mt -73.49 -29.06 62.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.946 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.33 -29.72 42.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.251 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.0 p -96.38 -38.88 9.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.048 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.936 ' HA ' HD21 ' A' ' 40' ' ' LEU . 21.4 mt-10 60.89 72.71 0.51 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.792 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.402 ' CB ' ' HD3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -100.08 -54.31 0.17 Allowed Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.634 -179.574 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.402 ' HD3' ' CB ' ' A' ' 38' ' ' GLN . 49.5 Cg_endo -83.69 -79.26 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.305 2.004 . . . . 0.0 113.111 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.936 HD21 ' HA ' ' A' ' 37' ' ' GLU . 1.2 mm? 46.7 40.73 9.11 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.846 0.355 . . . . 0.0 111.444 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.637 ' HB1' ' HD3' ' A' ' 43' ' ' LYS . . . 63.2 127.31 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.254 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 41' ' ' ALA . 25.6 Cg_exo -62.43 -25.63 76.19 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.494 2.129 . . . . 0.0 112.418 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.637 ' HD3' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -76.1 -30.94 58.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.325 -179.671 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -108.15 -62.6 1.43 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.054 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.9 mttt 63.72 31.35 14.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.804 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.7 t70 59.89 161.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.944 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -171.26 161.26 5.28 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.766 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--N 1.344 0.317 0 C-N-CA 122.551 2.167 . . . . 0.0 112.322 179.912 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 . . . . . 0 N--CA 1.457 -0.077 0 CA-C-O 120.888 0.375 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.407 ' CG ' ' HB3' ' A' ' 70' ' ' GLN . 14.2 m-85 -60.76 156.27 17.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.83 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.565 ' O ' HG13 ' A' ' 68' ' ' VAL . 9.2 mtm-85 -165.78 175.58 8.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.859 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.582 ' HG3' HG22 ' A' ' 68' ' ' VAL . 14.9 tt0 -159.65 118.78 2.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.918 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.2 p -121.71 -176.88 3.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.852 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.524 ' NE2' HD23 ' A' ' 66' ' ' LEU . 7.3 m-70 -133.84 86.21 2.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.899 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.557 HD23 HD12 ' A' ' 67' ' ' LEU . 4.0 pp -59.11 -33.42 70.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.862 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.462 ' HE3' HD13 ' A' ' 65' ' ' LEU . 6.6 mtmt -111.4 167.31 9.25 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.77 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.29 -12.85 37.32 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.501 2.134 . . . . 0.0 112.482 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -154.7 54.42 0.67 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.727 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.462 HD13 ' HE3' ' A' ' 62' ' ' LYS . 0.2 OUTLIER -151.04 125.69 9.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.908 -179.824 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.77 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -91.87 161.53 14.8 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.612 179.709 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.557 HD12 HD23 ' A' ' 61' ' ' LEU . 5.7 tt -160.5 94.1 1.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.911 0.386 . . . . 0.0 111.112 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.582 HG22 ' HG3' ' A' ' 58' ' ' GLU . 34.7 t -89.96 136.33 24.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.341 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -154.39 154.03 32.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.852 0.358 . . . . 0.0 111.272 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.407 ' HB3' ' CG ' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -133.79 123.01 24.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.783 179.917 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.541 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -88.42 126.81 41.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.784 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.401 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -96.59 99.7 11.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.681 179.702 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.69 -23.05 26.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.204 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -50.97 -34.63 29.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.909 0.385 . . . . 0.0 111.047 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -143.89 16.82 1.77 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.202 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 m120 47.62 68.74 0.61 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.757 0.313 . . . . 0.0 111.343 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.401 ' HB ' ' CG ' ' A' ' 72' ' ' LYS . 97.9 m -128.32 138.68 52.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.052 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.67 HD12 HD22 ' A' ' 2' ' ' LEU . 1.2 tt -95.74 92.06 6.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.721 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.413 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 3.9 t80 -91.48 118.03 30.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.882 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.662 HD11 HD21 ' A' ' 27' ' ' LEU . 4.8 mt -76.14 179.38 5.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.69 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.406 ' N ' ' O ' ' A' ' 68' ' ' VAL . 90.9 t -150.36 -73.89 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.113 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.504 ' HB2' HG23 ' A' ' 68' ' ' VAL . 9.4 mtp85 -98.03 167.86 10.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.956 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.567 HD12 HD12 ' A' ' 17' ' ' LEU . 0.3 OUTLIER -178.3 90.14 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.876 179.974 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.835 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 176.49 175.74 44.08 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.402 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.9 t -98.01 151.58 20.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.901 0.381 . . . . 0.0 110.842 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -68.04 -47.58 68.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.922 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 29.7 p -60.54 -31.89 70.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.858 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.86 -60.52 2.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.872 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.744 HD21 ' OD1' ' A' ' 13' ' ' ASP . 3.8 mp . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.887 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.536 HD23 ' N ' ' A' ' 2' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.831 0.348 . . . . 0.0 110.891 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -178.52 0.05 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.964 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.407 HD12 ' N ' ' A' ' 4' ' ' ILE . 4.3 mp -127.81 120.93 55.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.132 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -112.56 165.5 12.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.735 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 71.6 p -134.47 149.65 50.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.056 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.416 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 1.4 t -105.43 -172.24 2.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.936 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -75.96 -54.72 6.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.821 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -64.46 -33.17 75.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.799 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.826 ' CZ ' HD13 ' A' ' 80' ' ' LEU . 89.6 t80 -61.93 -30.09 70.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.906 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -68.99 -53.29 21.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.038 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.5 ptmm? -70.84 -10.37 59.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.48 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -85.82 -27.97 24.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.713 0.292 . . . . 0.0 110.946 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 14' ' ' LEU . 3.1 tp -83.44 -34.79 25.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.058 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.9 pttt -59.02 -29.24 67.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.169 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.2 mm -76.08 -39.46 36.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.327 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.674 HD11 ' HA2' ' A' ' 84' ' ' GLY . 10.7 mt -70.76 -44.22 67.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.014 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.1 p -59.76 -28.42 40.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.066 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -78.44 -30.51 47.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.887 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -87.27 -39.8 15.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.966 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 159.56 76.14 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.601 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -147.05 165.84 28.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.808 0.337 . . . . 0.0 110.862 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -125.3 165.98 17.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.963 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.9 mp -90.28 -54.25 4.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.8 mmtt -58.24 -22.96 54.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.1 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.574 ' O ' HG23 ' A' ' 30' ' ' VAL . 3.0 tm? -54.21 -52.74 60.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.033 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.6 -30.65 70.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.96 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -73.24 -26.45 61.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.085 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.23 -33.79 24.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.005 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 26' ' ' LEU . 41.0 t -71.59 -16.82 19.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.447 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.2 t -49.53 -28.33 3.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 120.828 0.347 . . . . 0.0 111.26 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -73.5 -26.72 69.2 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.42 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -90.11 -29.3 18.41 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.758 0.313 . . . . 0.0 110.857 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.3 mt -66.04 -37.92 87.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.904 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.47 -31.61 60.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.111 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 43.4 p -82.51 -44.03 16.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.853 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.639 ' HA ' HD11 ' A' ' 40' ' ' LEU . 16.8 mt-10 61.29 51.9 4.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.945 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -93.55 -53.02 0.25 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.139 -179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -85.12 -88.97 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.513 2.142 . . . . 0.0 112.726 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.639 HD11 ' HA ' ' A' ' 37' ' ' GLU . 0.8 OUTLIER 56.17 28.79 13.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.801 0.334 . . . . 0.0 111.127 180.0 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 61.66 116.44 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.053 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -66.85 -26.27 44.8 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.424 2.083 . . . . 0.0 112.324 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.71 -30.82 71.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.986 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -108.71 -59.51 1.87 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.956 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.4 mttm 63.99 134.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.944 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -66.73 155.15 38.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.954 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 10.9 p-80 -171.48 156.18 4.29 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.897 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo . . . . . 0 C--N 1.344 0.323 0 C-N-CA 122.616 2.211 . . . . 0.0 112.19 179.959 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.82 0.343 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.553 ' HE2' HG11 ' A' ' 81' ' ' VAL . 2.5 m-85 -74.94 141.72 44.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.858 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.3 mtt180 -156.74 152.91 27.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.849 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -131.39 149.5 52.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.025 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.568 ' SG ' HD23 ' A' ' 67' ' ' LEU . 32.1 p -139.54 -173.25 3.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.778 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -138.86 85.04 2.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.948 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.491 HD23 HD22 ' A' ' 67' ' ' LEU . 2.1 pp -64.81 -41.08 96.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.816 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.432 ' HD3' HD22 ' A' ' 65' ' ' LEU . 8.0 mttt -102.65 166.61 11.65 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.833 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.85 -12.28 34.85 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.576 2.184 . . . . 0.0 112.425 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -154.33 52.05 0.66 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.888 0.375 . . . . 0.0 110.614 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.432 HD22 ' HD3' ' A' ' 62' ' ' LYS . 0.7 OUTLIER -152.6 127.78 9.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.955 -179.705 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.783 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -89.92 166.33 13.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.502 179.7 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.568 HD23 ' SG ' ' A' ' 59' ' ' CYS . 43.9 tp -159.46 98.57 1.41 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.967 0.413 . . . . 0.0 111.614 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.444 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 19.9 t -95.08 124.74 47.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.691 178.446 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.462 ' CD1' ' CD1' ' A' ' 71' ' ' ILE . 7.8 p90 -141.18 163.39 33.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.128 0.49 . . . . 0.0 111.534 -179.176 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -141.66 107.62 5.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.399 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.566 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -84.88 146.28 6.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.014 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.17 104.72 10.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.693 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -59.96 -21.02 60.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.176 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.1 tp-100 -52.46 -33.6 45.2 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.104 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -144.32 17.19 1.7 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.268 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 47.38 74.79 0.15 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.894 0.378 . . . . 0.0 111.234 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 82.3 m -134.46 148.72 50.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.996 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.479 ' HB2' HD12 ' A' ' 2' ' ' LEU . 1.2 tt -107.67 93.04 4.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.63 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.416 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.7 t80 -89.99 105.74 18.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.991 -179.746 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.826 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 3.8 mt -65.73 -179.38 0.67 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.521 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.553 HG11 ' HE2' ' A' ' 56' ' ' PHE . 59.9 t -154.81 -59.53 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.24 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.408 ' HB2' ' CG2' ' A' ' 68' ' ' VAL . 0.0 OUTLIER -113.25 165.95 11.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.85 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.497 ' CD2' HD13 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -177.84 99.16 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.963 -179.944 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.783 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 165.29 -161.39 34.8 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.39 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.2 p -123.03 155.51 36.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.751 0.31 . . . . 0.0 110.976 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -69.17 -31.53 70.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.97 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.1 t -74.78 -34.98 62.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.945 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.93 -57.2 4.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.898 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.971 179.916 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.572 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.035 0 CA-C-O 120.822 0.344 . . . . 0.0 110.844 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.665 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -80.26 -173.61 4.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.882 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.4 mp -139.9 112.98 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.99 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -112.41 162.45 15.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.749 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.622 HG22 HD12 ' A' ' 80' ' ' LEU . 74.4 p -141.95 143.3 33.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.074 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.27 175.28 9.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.968 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.5 mtmt -64.79 -45.74 85.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.836 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -61.14 -21.71 64.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.092 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CZ ' ' HB2' ' A' ' 83' ' ' LEU . 1.0 OUTLIER -65.31 -32.45 74.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.004 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.12 -44.43 79.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.935 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.23 -8.85 59.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.371 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.14 -27.27 19.72 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.669 0.271 . . . . 0.0 111.257 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.9 -41.71 11.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.462 -179.628 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.6 pttm -54.67 -24.31 21.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.345 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.2 mm -83.43 -32.16 8.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.108 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.526 HD13 HD21 ' A' ' 65' ' ' LEU . 91.2 mt -82.03 -38.05 25.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.051 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.0 p -59.27 -30.48 44.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.115 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.31 -45.89 24.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.819 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -71.66 -31.6 67.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.82 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 149.56 75.98 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.543 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.718 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 8.2 t80 -153.7 165.46 35.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.876 0.369 . . . . 0.0 110.907 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -145.51 164.5 31.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.821 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.6 mp -94.77 -29.04 14.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.948 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -33.35 69.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.919 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.718 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 4.4 pp -74.1 -30.66 62.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.021 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.468 ' HA ' HG12 ' A' ' 30' ' ' VAL . 7.3 tt -73.78 -25.99 60.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.137 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.607 ' O ' HG22 ' A' ' 31' ' ' VAL . 0.7 OUTLIER -81.01 -28.58 35.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.094 -179.936 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.73 -36.11 17.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.042 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.468 HG12 ' HA ' ' A' ' 27' ' ' LEU . 13.1 p -62.6 -21.12 26.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.392 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.607 HG22 ' O ' ' A' ' 28' ' ' TYR . 27.8 m -47.68 -32.56 2.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.834 0.349 . . . . 0.0 111.462 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.83 -26.52 74.29 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.474 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -89.88 -27.38 19.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.744 0.307 . . . . 0.0 110.967 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 69.2 mt -66.49 -43.93 84.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.015 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.03 -37.43 72.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.276 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 53.3 p -78.7 -41.44 31.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.021 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.817 ' HA ' HD21 ' A' ' 40' ' ' LEU . 9.2 mt-10 62.08 49.95 4.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.87 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.552 ' H ' ' HD2' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -98.76 -61.76 0.11 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.641 -179.827 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.552 ' HD2' ' H ' ' A' ' 38' ' ' GLN . 30.1 Cg_endo -63.66 -85.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.274 1.983 . . . . 0.0 112.958 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.817 HD21 ' HA ' ' A' ' 37' ' ' GLU . 1.1 mm? 47.61 -173.1 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.801 0.334 . . . . 0.0 111.376 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.404 ' HB1' ' HE2' ' A' ' 43' ' ' LYS . . . -105.25 145.64 31.16 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.12 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.408 ' HA ' ' HD2' ' A' ' 45' ' ' LYS . 73.5 Cg_endo -75.72 -28.92 7.62 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.618 2.212 . . . . 0.0 112.352 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.404 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 2.9 pttt -76.71 -27.28 55.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.044 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.501 ' CD2' ' CG ' ' A' ' 60' ' ' HIS . 19.8 m-85 -105.29 -54.6 2.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.926 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HD2' ' HA ' ' A' ' 42' ' ' PRO . 0.0 OUTLIER 62.92 147.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.803 -179.896 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -87.19 134.53 33.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.976 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.416 ' CG ' ' HD2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -173.22 162.44 3.48 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.857 179.928 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.416 ' HD2' ' CG ' ' A' ' 47' ' ' HIS . 44.0 Cg_endo . . . . . 0 C--N 1.345 0.355 0 C-N-CA 122.583 2.189 . . . . 0.0 112.264 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 . . . . . 0 C--O 1.23 0.046 0 CA-C-O 120.843 0.354 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.422 ' CE2' HG21 ' A' ' 81' ' ' VAL . 7.8 m-85 -89.89 137.42 32.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.844 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.3 mtt180 -154.34 148.64 26.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.862 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.437 ' HG3' HG22 ' A' ' 68' ' ' VAL . 30.9 tt0 -118.2 150.04 40.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.04 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 30.4 p -148.47 151.41 35.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.857 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.501 ' CG ' ' CD2' ' A' ' 44' ' ' TYR . 17.2 m-70 -107.83 92.42 4.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.899 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.754 HD12 ' HB2' ' A' ' 62' ' ' LYS . 4.3 pp -68.04 -30.87 70.19 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.782 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.754 ' HB2' HD12 ' A' ' 61' ' ' LEU . 33.2 tptt -140.24 139.55 21.23 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.61 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_exo -43.44 132.96 7.07 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.565 2.177 . . . . 0.0 112.419 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 65.87 25.58 11.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.799 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.526 HD21 HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -145.81 120.0 9.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.712 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.478 HD11 ' HA ' ' A' ' 85' ' ' SER . 0.0 OUTLIER -101.43 -178.25 3.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.679 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.521 ' HG ' HD23 ' A' ' 83' ' ' LEU . 6.8 tt -167.92 103.55 0.48 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.071 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.437 HG22 ' HG3' ' A' ' 58' ' ' GLU . 24.8 t -94.88 138.98 19.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.543 179.593 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.754 ' HA ' HG23 ' A' ' 81' ' ' VAL . 6.1 p90 -147.85 161.95 40.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 0.0 111.31 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -128.52 120.24 26.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.438 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.518 ' N ' HD13 ' A' ' 71' ' ' ILE . 3.0 mm -84.71 141.51 14.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.38 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.427 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -127.45 87.5 2.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.695 179.806 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -56.39 -22.53 32.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.248 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -50.11 -32.82 16.83 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.891 0.377 . . . . 0.0 111.118 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -142.9 16.6 1.95 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.179 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 47.43 68.3 0.67 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.843 0.354 . . . . 0.0 111.22 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.665 HG23 ' HB ' ' A' ' 3' ' ' THR . 88.7 m -133.41 136.29 45.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.911 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.572 ' HB2' HD12 ' A' ' 2' ' ' LEU . 34.3 tp -95.06 92.37 6.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.727 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -90.08 115.74 27.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.966 -179.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.622 HD12 HG22 ' A' ' 6' ' ' THR . 30.6 mt -73.27 171.52 12.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.742 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.754 HG23 ' HA ' ' A' ' 69' ' ' TYR . 57.9 t -133.51 -70.22 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.291 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -118.45 175.78 5.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.117 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.521 HD23 ' HG ' ' A' ' 67' ' ' LEU . 0.4 OUTLIER -173.47 90.96 0.08 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.849 -179.983 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.62 127.92 1.49 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.749 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.478 ' HA ' HD11 ' A' ' 66' ' ' LEU . 0.6 OUTLIER -54.33 154.91 4.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.829 0.347 . . . . 0.0 111.127 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.84 -33.59 75.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.897 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.36 -32.35 60.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.875 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -67.18 -48.06 69.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.912 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.823 179.985 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.823 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.828 0.347 . . . . 0.0 110.808 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.467 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -57.96 -176.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.015 -179.806 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.51 HG12 HG21 ' A' ' 31' ' ' VAL . 4.3 mp -136.36 115.26 15.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.994 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -108.64 159.68 16.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.813 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 39.9 p -139.19 150.05 45.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.926 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.4 ' HB2' ' CZ ' ' A' ' 79' ' ' PHE . 0.1 OUTLIER -118.19 -168.83 1.59 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.944 179.975 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -78.07 -46.08 21.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.898 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -61.47 -33.79 74.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.771 ' CZ ' HD11 ' A' ' 14' ' ' LEU . 13.2 t80 -69.88 -37.68 76.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -72.94 -29.52 63.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.978 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -76.22 -23.19 54.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.153 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.456 ' OD1' HD11 ' A' ' 89' ' ' LEU . 0.4 OUTLIER -84.37 -46.79 11.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.069 -179.817 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.771 HD11 ' CZ ' ' A' ' 10' ' ' PHE . 81.0 mt -59.79 -37.46 79.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.096 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt -56.95 -26.83 60.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.141 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.9 mm -82.45 -33.65 11.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.172 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.3 mt -79.99 -41.3 26.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.033 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.6 p -57.84 -29.55 35.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.157 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.2 tttt -81.21 -31.22 34.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.93 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -100.43 30.39 3.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.971 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.11 95.3 0.81 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.592 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.686 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 11.4 t80 -176.6 113.39 0.1 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.814 0.34 . . . . 0.0 110.831 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.499 ' HB2' HD23 ' A' ' 26' ' ' LEU . 5.0 m-20 -74.85 160.39 30.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.956 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.82 -28.2 14.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.993 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.9 mtmm -69.23 -29.6 67.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.957 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.686 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 4.4 pp -58.6 -30.97 67.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.953 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.64 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -75.99 -23.91 55.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.159 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -82.44 -30.55 29.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.785 0.326 . . . . 0.0 111.003 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -88.31 -33.46 18.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.031 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.546 HG22 ' HG ' ' A' ' 34' ' ' LEU . 10.8 p -62.74 -21.52 27.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.321 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.51 HG21 HG12 ' A' ' 4' ' ' ILE . 36.1 t -47.5 -38.33 5.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.293 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.422 ' O ' HG23 ' A' ' 36' ' ' THR . . . -64.27 -32.57 84.64 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.387 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -89.99 -23.19 21.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.748 0.309 . . . . 0.0 111.173 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.546 ' HG ' HG22 ' A' ' 30' ' ' VAL . 52.3 mt -69.77 -40.44 76.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.054 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.414 ' HB2' HD11 ' A' ' 2' ' ' LEU . . . -72.8 -36.6 67.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.276 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.422 HG23 ' O ' ' A' ' 32' ' ' GLY . 25.7 p -83.32 -42.5 17.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.93 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.448 ' HA ' HD11 ' A' ' 40' ' ' LEU . 13.3 mt-10 61.04 58.67 2.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.857 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.406 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 0.5 OUTLIER -88.71 -51.74 0.38 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.517 -179.65 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.406 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 63.1 Cg_endo -77.82 -91.29 0.0 OUTLIER 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 122.174 1.916 . . . . 0.0 112.696 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.57 HD21 ' HB2' ' A' ' 59' ' ' CYS . 3.1 mp 56.51 -178.85 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.801 0.334 . . . . 0.0 111.038 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -94.78 142.15 24.3 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.0 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -74.73 -24.47 13.39 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.553 2.169 . . . . 0.0 112.47 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.54 -29.23 26.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.093 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -95.36 -62.11 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.109 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 mmtt 62.33 149.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.847 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.422 ' HB2' ' CD2' ' A' ' 40' ' ' LEU . 40.8 t0 -93.72 142.5 27.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.997 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 9.9 p80 -154.85 142.29 13.85 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.76 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo . . . . . 0 C--N 1.344 0.312 0 C-N-CA 122.482 2.121 . . . . 0.0 112.405 -179.863 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.839 0.352 . . . . 0.0 110.947 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -62.3 139.49 58.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.857 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 56.1 mtm180 -154.65 135.45 13.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.847 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -110.39 119.18 38.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.849 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.57 ' HB2' HD21 ' A' ' 40' ' ' LEU . 24.7 p -127.0 144.61 50.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.781 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -108.06 83.17 1.75 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.028 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 pp -59.04 -32.41 69.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.671 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.651 ' HB2' HD12 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -113.62 170.06 5.77 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.679 179.815 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.425 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 55.1 Cg_endo -70.1 -8.38 23.47 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.384 2.056 . . . . 0.0 112.781 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -151.43 40.69 0.69 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.739 0.304 . . . . 0.0 111.137 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.651 HD12 ' HB2' ' A' ' 62' ' ' LYS . 27.4 mt -131.59 133.7 45.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.052 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.653 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -113.96 116.16 28.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.716 179.739 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.722 ' HG ' HD12 ' A' ' 83' ' ' LEU . 0.4 OUTLIER -113.97 94.62 4.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.998 0.428 . . . . 0.0 111.143 -179.832 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.541 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 26.2 t -96.84 69.87 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.841 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.618 ' HD2' HD22 ' A' ' 67' ' ' LEU . 3.1 p90 -89.51 177.14 6.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.098 0.475 . . . . 0.0 111.345 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -146.15 122.51 10.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.709 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.547 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -92.65 138.17 20.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.852 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.09 102.5 11.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.658 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.63 -20.5 56.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.263 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -52.88 -29.42 28.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.734 0.302 . . . . 0.0 111.081 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -149.23 19.13 0.96 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.277 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 34.8 m120 46.46 74.77 0.14 Allowed 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.731 0.3 . . . . 0.0 111.303 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.467 HG23 ' HB ' ' A' ' 3' ' ' THR . 53.9 m -133.81 147.45 51.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.165 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.823 ' HB2' HD12 ' A' ' 2' ' ' LEU . 0.9 OUTLIER -107.4 95.59 5.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.553 179.596 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CZ ' ' HB2' ' A' ' 7' ' ' SER . 5.4 t80 -89.9 111.65 22.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.866 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.516 HD12 HD21 ' A' ' 67' ' ' LEU . 3.1 mm? -68.23 168.96 11.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.607 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.541 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 98.3 t -152.02 -84.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.432 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 11.1 mtm-85 -96.23 160.44 14.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.865 0.364 . . . . 0.0 111.254 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.722 HD12 ' HG ' ' A' ' 67' ' ' LEU . 0.3 OUTLIER -179.64 114.22 0.05 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.612 179.816 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.653 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 145.55 -159.93 28.0 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.42 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.414 ' O ' HD12 ' A' ' 89' ' ' LEU . 0.3 OUTLIER -121.22 141.05 51.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.809 0.338 . . . . 0.0 110.828 179.854 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -58.95 -30.35 67.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.914 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.1 m -78.23 -32.68 49.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.922 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -70.0 -46.88 64.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.958 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.456 HD11 ' OD1' ' A' ' 13' ' ' ASP . 4.0 mp . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.92 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.804 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.901 0.382 . . . . 0.0 110.922 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.648 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -65.51 -175.57 0.27 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.841 -179.994 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.557 HG12 HG11 ' A' ' 31' ' ' VAL . 4.2 mp -133.37 116.19 24.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.108 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -110.19 168.18 9.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.81 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.431 HG22 ' CE2' ' A' ' 10' ' ' PHE . 77.6 p -138.41 147.93 43.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.894 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.404 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 2.6 t -105.71 -168.19 1.42 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.886 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -74.53 -58.18 3.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.966 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -58.88 -34.56 71.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.964 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.593 ' HZ ' HD21 ' A' ' 27' ' ' LEU . 10.7 t80 -60.29 -34.86 74.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.927 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.32 -35.02 63.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.862 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.7 mtpp -82.11 -20.96 37.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.087 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.566 ' CG ' HD21 ' A' ' 89' ' ' LEU . 2.0 m-20 -84.1 -28.44 27.52 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.139 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -83.8 -36.49 23.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.161 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 12.6 pttp -58.6 -29.98 66.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.055 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.4 mm -83.62 -33.24 9.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.118 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.564 HD11 ' CA ' ' A' ' 84' ' ' GLY . 18.1 mt -73.68 -43.14 60.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.912 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.2 p -60.24 -30.93 47.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.11 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -72.92 -33.74 66.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.804 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -84.97 -48.74 8.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.927 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 163.3 76.95 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.501 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.867 ' CE1' HD11 ' A' ' 26' ' ' LEU . 56.4 t80 -153.07 116.8 4.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.858 0.361 . . . . 0.0 110.908 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.47 156.13 24.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.866 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.3 mp -91.36 -29.93 16.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.913 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -58.81 -36.87 75.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.97 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.867 HD11 ' CE1' ' A' ' 22' ' ' PHE . 3.9 pp -66.35 -30.67 71.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.885 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.593 HD21 ' HZ ' ' A' ' 10' ' ' PHE . 9.1 tp -71.71 -29.07 64.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.983 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.515 ' O ' HG22 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -83.21 -25.22 31.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.956 179.936 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 mttt -88.04 -34.45 17.99 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.075 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.4 p -60.28 -19.63 18.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.331 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.557 HG11 HG12 ' A' ' 4' ' ' ILE . 29.4 m -48.7 -41.06 12.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.827 0.346 . . . . 0.0 111.362 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.414 ' N ' HG23 ' A' ' 31' ' ' VAL . . . -60.66 -27.5 66.42 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.371 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -89.29 -30.01 18.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 0.0 110.871 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.3 mt -63.38 -38.07 89.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.873 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.93 -51.97 14.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.079 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.5 p -66.35 -44.54 82.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.917 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.749 ' HA ' HD11 ' A' ' 40' ' ' LEU . 33.6 mt-10 60.42 51.92 5.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.891 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.4 ' N ' ' CD ' ' A' ' 39' ' ' PRO . 0.5 OUTLIER -91.31 -52.12 0.3 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.233 -179.841 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.4 ' CD ' ' N ' ' A' ' 38' ' ' GLN . 74.3 Cg_endo -84.18 -92.13 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.406 2.071 . . . . 0.0 112.684 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.749 HD11 ' HA ' ' A' ' 37' ' ' GLU . 0.6 OUTLIER 54.55 36.78 26.63 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-O 120.849 0.357 . . . . 0.0 111.143 -179.967 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.54 127.95 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.08 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -77.27 -3.4 13.65 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.482 2.121 . . . . 0.0 112.832 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -102.63 -32.38 9.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 0.0 111.023 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -95.25 -52.68 4.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.904 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.2 mmtt 62.69 148.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.794 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.538 ' CB ' HD13 ' A' ' 40' ' ' LEU . 59.5 t0 -91.51 139.56 30.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.949 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 11.8 p-80 -158.42 146.42 13.78 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.79 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo . . . . . 0 C--N 1.346 0.398 0 C-N-CA 122.532 2.155 . . . . 0.0 112.337 179.979 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.768 0.318 . . . . 0.0 111.029 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.413 ' HE1' HG21 ' A' ' 81' ' ' VAL . 9.9 m-85 -78.02 143.98 37.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.832 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -156.4 142.8 18.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.595 -179.512 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.413 ' CG ' HG22 ' A' ' 68' ' ' VAL . 24.1 tt0 -128.5 148.89 50.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.124 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 32.1 p -137.15 -172.46 3.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.631 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -143.73 85.84 1.85 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.981 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.701 ' CD2' HD12 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -61.01 -43.43 98.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.75 179.843 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.504 ' HD2' HD12 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -99.51 166.36 13.03 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.859 179.827 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.39 -3.53 14.02 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.749 2.299 . . . . 0.0 112.972 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -147.59 33.83 0.86 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.609 0.242 . . . . 0.0 111.08 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 mp -151.84 145.59 25.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.903 0.382 . . . . 0.0 111.098 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -110.53 -173.19 2.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.293 179.602 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.87 HD21 ' CD1' ' A' ' 80' ' ' LEU . 4.1 tt -169.99 103.58 0.31 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.876 0.37 . . . . 0.0 111.431 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.413 HG22 ' CG ' ' A' ' 58' ' ' GLU . 13.7 t -94.66 120.95 44.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.09 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.672 ' HD2' HD22 ' A' ' 67' ' ' LEU . 6.3 p90 -137.78 159.54 41.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.004 0.431 . . . . 0.0 111.433 -179.571 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -132.42 122.74 25.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.505 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.529 ' N ' HD13 ' A' ' 71' ' ' ILE . 3.0 mm -84.74 131.04 34.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.41 -179.568 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.431 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -111.82 85.02 2.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.665 179.757 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.0 mttt -56.19 -23.02 32.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.264 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -51.97 -30.38 24.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.845 0.355 . . . . 0.0 111.047 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -142.25 16.47 2.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.311 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 47.05 69.31 0.51 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.858 0.361 . . . . 0.0 111.311 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.648 HG23 ' HB ' ' A' ' 3' ' ' THR . 49.3 m -139.13 143.67 38.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.067 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.804 ' HB2' HD12 ' A' ' 2' ' ' LEU . 0.6 OUTLIER -97.29 96.45 8.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.668 179.722 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.408 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 3.7 t80 -94.39 114.19 26.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.945 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.87 ' CD1' HD21 ' A' ' 67' ' ' LEU . 3.0 mm? -69.62 169.86 11.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.797 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.574 HG23 ' HA ' ' A' ' 69' ' ' TYR . 35.1 t -136.41 -63.66 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.069 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.8 ttt85 -133.07 172.52 12.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.914 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.736 HD12 ' HG ' ' A' ' 67' ' ' LEU . 1.9 tt -176.84 146.53 0.55 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.949 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.564 ' CA ' HD11 ' A' ' 17' ' ' LEU . . . 99.94 129.52 6.64 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.488 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -52.68 138.93 27.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.84 0.352 . . . . 0.0 111.09 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -30.12 66.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.936 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.9 p -64.65 -32.96 74.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -73.73 -44.81 55.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.91 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.566 HD21 ' CG ' ' A' ' 13' ' ' ASP . 5.0 mp . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.1 mt . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.763 0.316 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.691 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -69.39 -177.32 1.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.862 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.512 HG12 HG11 ' A' ' 31' ' ' VAL . 3.8 mp -133.8 116.91 24.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.196 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -110.49 159.81 17.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.712 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 34.2 p -130.93 149.85 52.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.115 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.9 t -106.13 -166.8 1.23 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.8 mtmm -82.85 -52.09 7.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.027 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.4 mmtp -70.24 -31.77 69.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.027 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.633 ' CE1' HD11 ' A' ' 14' ' ' LEU . 76.4 t80 -59.95 -53.66 55.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.884 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.29 -31.03 68.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.988 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -82.35 -20.03 38.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.179 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.515 ' O ' HD23 ' A' ' 17' ' ' LEU . 2.7 m-20 -85.37 -28.36 25.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.19 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.669 ' O ' HG23 ' A' ' 18' ' ' VAL . 3.9 mp -81.59 -37.65 27.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.162 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.1 ptpt -58.27 -29.77 66.07 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.089 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.1 mm -81.05 -43.81 20.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.069 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.574 ' CD1' HD21 ' A' ' 65' ' ' LEU . 2.1 mm? -56.62 -26.84 56.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.924 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.669 HG23 ' O ' ' A' ' 14' ' ' LEU . 20.6 t -57.41 -54.59 28.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.126 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.1 tptm -59.18 -28.67 66.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.08 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -97.84 33.57 2.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.973 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.79 88.35 0.38 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.486 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.456 ' CE1' HD11 ' A' ' 26' ' ' LEU . 7.4 t80 -176.56 166.84 2.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.74 0.305 . . . . 0.0 110.838 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -157.01 158.99 37.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.912 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -88.39 -29.68 20.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.003 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -63.58 -45.2 91.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.906 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.742 HD12 ' N ' ' A' ' 27' ' ' LEU . 4.3 pp -60.1 -31.63 70.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.921 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.742 ' N ' HD12 ' A' ' 26' ' ' LEU . 3.7 tt -76.26 -28.7 57.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.913 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.641 ' O ' HG22 ' A' ' 31' ' ' VAL . 0.2 OUTLIER -59.11 -29.49 67.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.907 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.61 -30.85 18.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.055 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.694 HG23 ' O ' ' A' ' 26' ' ' LEU . 34.6 t -64.38 -22.49 31.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.247 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 28' ' ' TYR . 29.1 m -50.35 -29.29 6.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.226 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -70.0 -33.74 70.24 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.397 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -86.32 -28.93 23.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.739 0.304 . . . . 0.0 110.881 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.547 ' HG ' HG12 ' A' ' 30' ' ' VAL . 90.0 mt -63.25 -38.31 90.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.831 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.24 -34.9 61.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.185 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 51.4 p -78.86 -41.35 30.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.837 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.409 ' HA ' HD21 ' A' ' 40' ' ' LEU . 26.8 mt-10 58.07 61.39 2.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.972 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.435 ' CB ' ' HD3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -102.48 -55.18 0.12 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.411 -179.79 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.435 ' HD3' ' CB ' ' A' ' 38' ' ' GLN . 41.7 Cg_endo -86.04 -76.36 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.379 2.053 . . . . 0.0 112.338 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.693 HD12 ' HB3' ' A' ' 59' ' ' CYS . 2.5 mm? 48.65 27.65 1.57 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.814 0.34 . . . . 0.0 111.433 179.523 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 62.11 121.01 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.116 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.95 -35.78 90.54 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.425 2.084 . . . . 0.0 112.388 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.73 -30.45 68.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.852 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -109.63 63.86 0.61 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.857 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.7 mttp -60.29 102.5 0.18 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.815 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -51.56 145.33 9.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.087 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -168.28 162.97 8.82 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.914 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo . . . . . 0 C--N 1.343 0.253 0 C-N-CA 122.605 2.204 . . . . 0.0 112.353 -179.93 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.742 0.306 . . . . 0.0 111.182 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -94.0 125.35 38.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.882 0.372 . . . . 0.0 110.908 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -145.07 155.26 43.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.783 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.41 ' HG3' HG22 ' A' ' 68' ' ' VAL . 29.7 tt0 -121.66 154.57 36.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.003 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.693 ' HB3' HD12 ' A' ' 40' ' ' LEU . 7.3 m -145.76 -169.99 3.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.895 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -139.03 110.8 7.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.898 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 1.056 HD23 HD12 ' A' ' 67' ' ' LEU . 3.7 pp -83.17 -38.26 22.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.85 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.42 ' CB ' ' HD2' ' A' ' 63' ' ' PRO . 2.7 mttm -108.13 169.36 6.69 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.788 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.42 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 47.5 Cg_endo -68.8 -9.39 26.1 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.466 2.11 . . . . 0.0 112.823 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -150.63 49.43 0.87 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.85 0.357 . . . . 0.0 110.941 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.574 HD21 ' CD1' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -159.31 140.66 12.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.113 180.0 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.62 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -101.53 -177.69 3.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.339 179.589 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 1.056 HD12 HD23 ' A' ' 61' ' ' LEU . 3.0 tt -170.02 102.64 0.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.821 0.343 . . . . 0.0 111.493 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.41 HG22 ' HG3' ' A' ' 58' ' ' GLU . 23.4 t -90.04 125.44 42.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.124 178.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.476 ' HD2' HD22 ' A' ' 67' ' ' LEU . 10.0 p90 -145.06 163.36 34.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.864 0.364 . . . . 0.0 111.422 -179.318 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.35 119.3 9.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.754 179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.564 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -85.07 146.32 6.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.9 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.52 103.7 10.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.88 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.3 mmtp -56.72 -21.93 31.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.212 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -47.44 -36.6 10.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.804 0.335 . . . . 0.0 111.312 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -148.36 20.99 1.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.194 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 48.96 73.59 0.22 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.853 0.359 . . . . 0.0 111.059 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.691 HG23 ' HB ' ' A' ' 3' ' ' THR . 99.8 m -132.45 147.4 52.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.915 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.01 91.81 3.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.732 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.42 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 4.3 t80 -89.94 121.11 31.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.833 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.994 HD12 HD21 ' A' ' 67' ' ' LEU . 3.0 mm? -76.76 176.08 8.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.74 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.439 HG23 ' HA ' ' A' ' 69' ' ' TYR . 60.5 t -145.35 -66.34 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.144 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 -123.39 169.07 11.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.962 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.4 HD13 HD11 ' A' ' 14' ' ' LEU . 8.7 tt -176.11 134.66 0.26 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.901 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.62 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 143.86 -141.43 10.28 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.591 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.3 m -134.61 175.62 9.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.907 0.385 . . . . 0.0 110.883 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -82.08 -32.58 30.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.4 m -78.65 -32.9 47.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.95 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.38 -58.77 3.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.905 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.83 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.413 HD23 ' OD1' ' A' ' 76' ' ' ASN . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.854 0.359 . . . . 0.0 110.912 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.643 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -68.36 -174.9 0.57 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.824 179.977 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -133.98 120.99 37.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.121 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -115.02 163.84 15.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.737 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.5 p -128.28 155.44 44.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.041 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 14.7 m -99.99 -178.37 3.83 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.984 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -74.16 -46.23 43.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.826 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -29.65 69.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.02 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.441 ' CE2' ' HB3' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -58.28 -38.98 78.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.997 179.975 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -61.86 -33.12 73.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.78 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -89.95 -21.63 22.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.139 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.443 ' OD1' HD21 ' A' ' 89' ' ' LEU . 86.7 m-20 -79.59 -25.94 41.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.155 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.1 mp -88.86 -38.44 14.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.26 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 48.6 pttt -57.86 -30.33 65.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.133 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.9 mm -85.19 -29.15 6.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.161 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.771 HD11 ' HA2' ' A' ' 84' ' ' GLY . 18.0 mt -81.22 -36.82 29.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.916 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.6 p -60.14 -26.21 35.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.111 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -90.09 -42.98 10.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.545 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -69.09 -30.88 69.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.534 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 147.87 80.35 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.41 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.937 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 8.9 t80 -157.57 171.88 19.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.941 0.401 . . . . 0.0 110.942 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -145.51 169.42 18.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.862 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.7 mp -97.67 -27.75 14.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.08 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -66.34 -34.18 77.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.952 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.937 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 3.9 pp -64.79 -34.34 78.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.892 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.568 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.6 OUTLIER -75.41 -41.25 56.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.883 179.965 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -72.42 -23.67 61.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.2 mmmt -90.04 -31.68 17.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.333 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.553 HG12 ' HA ' ' A' ' 27' ' ' LEU . 12.7 p -80.8 -7.4 10.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.865 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 27' ' ' LEU . 43.5 t -53.94 -42.02 51.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-O 120.778 0.323 . . . . 0.0 111.125 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.81 -27.0 72.33 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.379 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -87.2 -19.41 28.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.589 0.233 . . . . 0.0 111.159 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.5 mt -77.95 -38.29 45.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.918 0.389 . . . . 0.0 110.983 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.81 -33.03 73.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.244 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 71.2 p -97.87 -31.49 12.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 60.86 58.94 2.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.874 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.475 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -75.35 -56.98 1.77 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.44 -179.876 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 25.0 Cg_endo -62.23 -82.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.063 1.842 . . . . 0.0 112.468 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.418 ' N ' HD22 ' A' ' 40' ' ' LEU . 3.0 mm? 46.56 97.36 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.121 0 CA-C-O 120.873 0.368 . . . . 0.0 111.549 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.37 146.86 4.38 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.371 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.16 -25.35 19.14 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.564 2.176 . . . . 0.0 112.461 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.3 -28.12 61.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.166 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -112.46 -66.79 1.05 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.156 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.3 tttt 63.06 149.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.867 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -76.33 121.46 23.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.841 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -149.22 163.97 23.03 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.899 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo . . . . . 0 C--N 1.343 0.281 0 C-N-CA 122.532 2.154 . . . . 0.0 112.208 179.898 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.802 0.334 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -108.4 145.3 34.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.884 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -159.02 128.4 5.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.747 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.638 ' HB2' HG22 ' A' ' 68' ' ' VAL . 0.8 OUTLIER -105.88 136.28 45.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.0 -179.8 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 32.0 p -129.2 149.61 50.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.682 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -107.12 86.05 2.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.142 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.509 HD12 ' N ' ' A' ' 62' ' ' LYS . 3.7 pp -59.22 -41.1 87.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.692 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.509 ' N ' HD12 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -111.98 167.67 8.79 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.748 179.738 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.8 -7.59 21.7 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.464 2.109 . . . . 0.0 112.943 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -148.32 42.37 1.0 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.762 0.315 . . . . 0.0 111.161 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 89.7 mt -154.33 135.63 14.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.906 0.384 . . . . 0.0 111.059 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.665 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -102.46 171.71 7.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.448 179.7 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.488 HD23 ' C ' ' A' ' 67' ' ' LEU . 5.6 tt -165.46 100.3 0.71 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.945 0.402 . . . . 0.0 111.356 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.638 HG22 ' HB2' ' A' ' 58' ' ' GLU . 33.6 t -96.18 135.44 30.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.034 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.689 ' HA ' HG23 ' A' ' 81' ' ' VAL . 5.8 p90 -146.0 161.98 38.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.995 0.426 . . . . 0.0 111.35 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -131.47 124.95 31.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.516 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.528 ' N ' HD13 ' A' ' 71' ' ' ILE . 2.9 mm -84.6 143.85 10.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.344 -179.51 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.415 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -127.85 87.72 2.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.714 179.848 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.7 pttt -57.69 -22.21 44.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.217 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -51.7 -32.21 29.12 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.847 0.356 . . . . 0.0 110.987 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -141.27 15.22 2.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.219 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.413 ' OD1' HD23 ' A' ' 2' ' ' LEU . 2.0 t30 47.54 69.91 0.47 Allowed 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 120.84 0.352 . . . . 0.0 111.156 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.643 HG23 ' HB ' ' A' ' 3' ' ' THR . 76.3 m -137.44 146.12 43.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.986 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 34.1 tp -101.0 92.33 4.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.776 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -90.77 114.02 26.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.86 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.441 ' HB3' ' CE2' ' A' ' 10' ' ' PHE . 2.6 mt -71.48 178.96 3.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.928 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.689 HG23 ' HA ' ' A' ' 69' ' ' TYR . 58.7 t -139.13 -70.85 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.105 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -129.99 171.49 12.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.975 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.7 tt -174.9 152.66 1.56 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.872 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.771 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 125.6 -156.99 19.56 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.467 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.3 t -119.99 133.93 55.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.933 0.397 . . . . 0.0 110.885 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -59.76 -47.73 84.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.972 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 25.1 p -64.56 -31.11 72.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.997 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -73.89 -56.51 4.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.443 HD21 ' OD1' ' A' ' 13' ' ' ASP . 3.3 mp . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.981 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.79 0.329 . . . . 0.0 110.85 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.42 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -60.66 -177.4 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.908 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -128.7 106.28 14.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.12 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -103.07 160.97 14.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.803 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.7 p -139.18 151.47 46.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.026 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 16.7 p -109.3 -168.57 1.35 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.821 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.0 -60.01 2.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.924 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.3 mttt -59.91 -33.36 71.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.906 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.442 ' CE1' ' HB3' ' A' ' 80' ' ' LEU . 75.1 t80 -59.46 -53.5 57.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.935 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.34 -29.96 69.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.028 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -83.47 -6.92 59.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.456 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.557 ' OD1' HD21 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -89.99 -29.76 18.23 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.689 0.281 . . . . 0.0 111.061 -179.816 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 pp -84.46 -38.39 20.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.071 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -59.19 -22.15 60.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.228 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.0 mm -88.98 -29.29 5.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.309 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.833 HD11 ' HA2' ' A' ' 84' ' ' GLY . 11.9 mt -79.79 -32.71 40.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.119 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.5 p -61.97 -30.83 49.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.141 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.65 -37.44 35.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.939 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -77.85 -31.33 51.44 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.869 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 145.58 80.17 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.526 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -153.48 161.16 42.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.831 0.348 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -107.96 172.58 6.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.905 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.582 ' N ' HD12 ' A' ' 24' ' ' LEU . 5.5 mp -99.47 -57.85 2.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.975 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -60.82 -21.5 63.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.053 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.904 ' O ' HG23 ' A' ' 30' ' ' VAL . 1.9 tm? -52.73 -54.07 38.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.881 0.372 . . . . 0.0 111.044 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 tt -61.02 -46.32 91.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.827 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.681 ' O ' HG22 ' A' ' 31' ' ' VAL . 4.8 m-85 -60.65 -25.09 66.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.998 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.68 -29.43 22.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.001 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 26' ' ' LEU . 25.6 t -67.76 -24.55 30.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.309 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.681 HG22 ' O ' ' A' ' 28' ' ' TYR . 32.1 m -48.02 -38.95 8.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.852 0.358 . . . . 0.0 111.38 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.23 -27.9 65.98 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.456 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -90.12 -22.45 21.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.662 0.268 . . . . 0.0 111.15 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.3 mt -69.33 -33.08 72.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.833 0.349 . . . . 0.0 110.93 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.75 -32.96 60.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.136 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.0 p -88.67 -46.24 9.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.667 ' C ' HD11 ' A' ' 40' ' ' LEU . 56.5 mt-10 62.03 55.61 2.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.861 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -93.86 -53.19 0.25 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.225 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -84.63 -88.89 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.49 2.126 . . . . 0.0 112.588 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.667 HD11 ' C ' ' A' ' 37' ' ' GLU . 0.4 OUTLIER 55.57 35.88 26.06 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.889 0.376 . . . . 0.0 111.134 179.934 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.585 ' HB1' ' HE2' ' A' ' 43' ' ' LYS . . . 60.14 109.4 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.069 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.82 -25.98 38.85 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.365 2.044 . . . . 0.0 112.414 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.585 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 3.3 pttt -66.78 -31.12 71.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.006 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -103.74 -39.3 6.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.933 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.5 mttm 63.61 127.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.879 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -61.39 146.57 47.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.017 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -160.13 150.7 15.38 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.826 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.41 ' HA ' ' HA ' ' A' ' 57' ' ' ARG . 17.9 Cg_endo . . . . . 0 C--N 1.344 0.327 0 C-N-CA 122.5 2.133 . . . . 0.0 112.36 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.949 0.404 . . . . 0.0 110.759 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -105.31 118.2 35.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.758 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.41 ' HA ' ' HA ' ' A' ' 48' ' ' PRO . 23.4 mtp180 -142.63 155.07 44.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.018 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.542 ' HB2' HG22 ' A' ' 68' ' ' VAL . 0.4 OUTLIER -129.79 143.14 50.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.839 179.972 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 21.1 m -134.94 177.43 7.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.837 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -130.18 83.4 2.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.958 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.738 HD22 HD12 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -55.92 -34.75 65.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.916 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 65' ' ' LEU . 12.8 mmtt -117.92 163.72 23.2 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.681 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.8 -19.29 30.6 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.654 2.236 . . . . 0.0 112.467 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -148.66 76.38 1.35 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.711 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 62' ' ' LYS . 0.2 OUTLIER -175.57 122.13 0.2 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.139 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.407 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -89.95 157.03 18.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.2 179.464 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.96 HD21 HD12 ' A' ' 80' ' ' LEU . 5.6 tt -153.16 98.35 2.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.902 0.382 . . . . 0.0 111.391 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.542 HG22 ' HB2' ' A' ' 58' ' ' GLU . 34.8 t -94.09 134.1 32.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.284 179.283 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.465 ' HB3' HD13 ' A' ' 80' ' ' LEU . 5.1 p90 -146.26 158.28 43.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.996 0.427 . . . . 0.0 111.312 -179.749 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -135.24 109.35 8.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.637 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.568 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -84.97 141.22 14.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.837 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.69 103.54 10.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.72 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm -59.98 -19.71 53.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.417 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -53.15 -30.34 36.4 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.747 0.308 . . . . 0.0 111.142 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -148.57 19.71 1.04 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.339 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 46.98 75.3 0.13 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.751 0.31 . . . . 0.0 111.283 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.42 HG23 ' HB ' ' A' ' 3' ' ' THR . 96.6 m -133.99 148.48 51.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.942 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.56 91.46 3.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.66 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.441 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 6.1 t80 -89.93 110.96 21.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.92 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.96 HD12 HD21 ' A' ' 67' ' ' LEU . 3.4 mm? -70.41 -178.01 1.62 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.603 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 82.5 t -152.47 -72.42 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.304 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.08 163.85 11.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.914 0.387 . . . . 0.0 111.096 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.464 ' C ' HD13 ' A' ' 83' ' ' LEU . 1.7 tm? -177.09 87.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.926 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.833 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 177.7 -136.61 3.1 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.512 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -140.32 147.86 40.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.744 0.307 . . . . 0.0 110.895 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -59.2 -39.8 83.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.062 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.1 t -75.42 -37.49 60.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.976 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.1 -57.82 5.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.922 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.557 HD21 ' OD1' ' A' ' 13' ' ' ASP . 2.2 mm? . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.856 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.833 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.843 0.354 . . . . 0.0 110.869 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.448 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -73.32 -175.72 2.0 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.793 179.937 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.777 HG12 HG11 ' A' ' 31' ' ' VAL . 4.1 mp -130.31 124.18 57.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.003 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -117.2 162.84 17.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.801 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 44.1 p -126.12 153.67 44.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.951 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.7 t -102.87 177.12 4.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.021 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.7 mtmm -74.02 -43.89 56.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.861 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.7 mmtm -79.07 -28.21 43.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.934 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.581 ' CE2' HD11 ' A' ' 14' ' ' LEU . 31.7 t80 -55.83 -34.33 65.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.978 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.474 ' HA ' HD12 ' A' ' 14' ' ' LEU . 73.6 m-20 -68.12 -31.69 71.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.867 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -78.63 -22.02 47.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.166 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.04 -27.34 33.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.107 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.581 HD11 ' CE2' ' A' ' 10' ' ' PHE . 4.8 mt -81.11 -37.77 28.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.106 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.458 ' HA ' HG12 ' A' ' 18' ' ' VAL . 15.7 ptmt -57.47 -28.85 63.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.129 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.9 mm -78.74 -28.72 14.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.328 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.623 ' CD1' HD21 ' A' ' 65' ' ' LEU . 26.5 mt -87.48 -40.68 14.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.115 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.458 HG12 ' HA ' ' A' ' 15' ' ' LYS . 12.5 p -57.62 -32.17 41.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.2 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt -77.54 -31.17 53.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.935 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -100.37 29.89 4.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.917 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.16 98.44 0.54 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.539 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.521 ' CE1' HD11 ' A' ' 26' ' ' LEU . 55.4 t80 -176.88 97.86 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.82 0.343 . . . . 0.0 110.932 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.406 ' HB3' HD23 ' A' ' 26' ' ' LEU . 4.7 t0 -68.83 160.87 29.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.889 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -94.21 -31.0 14.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.894 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.73 -34.86 73.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.977 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.521 HD11 ' CE1' ' A' ' 22' ' ' PHE . 4.2 pp -61.15 -35.68 77.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.869 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.501 ' HA ' HG12 ' A' ' 30' ' ' VAL . 4.5 tp -77.07 -29.48 55.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.972 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.627 ' O ' HG22 ' A' ' 31' ' ' VAL . 2.5 m-85 -79.49 -25.54 41.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.069 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.34 -32.06 17.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.088 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.501 HG12 ' HA ' ' A' ' 27' ' ' LEU . 13.7 p -71.39 -14.32 17.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.582 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.777 HG11 HG12 ' A' ' 4' ' ' ILE . 18.3 m -51.73 -46.35 38.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.841 0.353 . . . . 0.0 111.365 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.472 ' N ' HG23 ' A' ' 31' ' ' VAL . . . -62.65 -26.39 68.41 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.413 179.859 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -88.71 -19.59 25.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.637 0.256 . . . . 0.0 111.162 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.863 HD21 ' HB3' ' A' ' 61' ' ' LEU . 70.7 mt -72.23 -45.93 58.2 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.842 0.353 . . . . 0.0 111.012 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.446 ' HB2' HD11 ' A' ' 2' ' ' LEU . . . -63.83 -30.59 71.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.23 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 73.5 p -92.38 -35.61 13.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.899 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 60.01 61.59 1.84 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.874 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.47 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 2.5 mt-30 -79.94 -56.67 0.73 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.564 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.47 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 36.5 Cg_endo -66.27 -86.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.029 1.819 . . . . 0.0 112.327 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.484 ' N ' HD22 ' A' ' 40' ' ' LEU . 3.6 mm? 44.63 92.64 0.01 OUTLIER 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.775 0.321 . . . . 0.0 111.625 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.708 ' HB1' ' HD2' ' A' ' 42' ' ' PRO . . . -59.33 165.63 3.69 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.708 ' HD2' ' HB1' ' A' ' 41' ' ' ALA . 11.2 Cg_endo -54.6 -68.95 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.522 2.148 . . . . 0.0 112.196 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.04 -30.65 71.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.753 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -108.56 55.08 0.64 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.693 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.96 -162.22 0.94 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.766 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -113.2 155.2 25.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.869 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 11.3 p-80 -165.6 145.42 5.5 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.825 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo . . . . . 0 C--N 1.346 0.404 0 C-N-CA 122.597 2.198 . . . . 0.0 112.298 179.972 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.9 t0 . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.8 0.333 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.414 ' CD1' ' HB2' ' A' ' 70' ' ' GLN . 10.1 m-85 -64.85 157.93 26.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.9 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.2 mtt85 -166.84 137.37 3.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.846 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.407 ' CG ' HG22 ' A' ' 68' ' ' VAL . 31.1 tt0 -109.68 130.66 55.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.904 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.2 p -144.64 175.35 10.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.839 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 55.9 m-70 -129.36 93.06 3.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.838 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.863 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -59.5 -34.56 72.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.906 179.925 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.404 ' HB2' ' HB2' ' A' ' 65' ' ' LEU . 0.1 OUTLIER -110.28 164.99 13.52 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.677 179.955 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.61 -12.69 34.86 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.508 2.139 . . . . 0.0 112.81 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.796 ' O ' HD12 ' A' ' 65' ' ' LEU . 3.1 t0 -149.91 65.38 0.98 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.953 0.406 . . . . 0.0 110.967 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.796 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.1 OUTLIER -163.88 159.29 20.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.853 179.91 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.688 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.3 OUTLIER -116.72 169.77 9.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.831 179.845 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.938 HD13 HD12 ' A' ' 83' ' ' LEU . 15.6 tp -170.01 94.91 0.26 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.031 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.543 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 39.2 t -99.49 69.65 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.897 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.581 ' CD1' HD21 ' A' ' 78' ' ' LEU . 9.2 p90 -89.52 172.89 8.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.057 0.456 . . . . 0.0 111.487 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HB2' ' CD1' ' A' ' 56' ' ' PHE . 2.6 tt0 -142.72 141.06 31.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.641 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.568 ' N ' HD13 ' A' ' 71' ' ' ILE . 2.8 mm -84.79 147.91 5.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.357 -179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.444 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -122.28 87.81 2.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.616 179.522 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.8 mmtt -53.01 -23.87 8.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.388 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -47.18 -33.12 4.95 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.194 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -149.07 20.45 0.98 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.193 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.8 m120 47.29 67.8 0.74 Allowed 'General case' 0 C--O 1.231 0.106 0 CA-C-O 120.848 0.356 . . . . 0.0 111.261 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.448 HG23 ' HB ' ' A' ' 3' ' ' THR . 16.0 m -133.96 150.82 51.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.05 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.833 ' HB2' HD12 ' A' ' 2' ' ' LEU . 1.1 tt -102.34 100.6 10.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.407 179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 2.6 t80 -93.77 112.7 24.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.017 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.576 HD12 ' CE2' ' A' ' 10' ' ' PHE . 23.1 mt -67.39 175.18 2.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.712 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.543 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 73.2 t -149.39 -85.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.414 -179.532 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.547 ' O ' HD12 ' A' ' 67' ' ' LEU . 2.7 mtt85 -99.0 162.51 13.03 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.917 0.389 . . . . 0.0 111.059 -179.676 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.938 HD12 HD13 ' A' ' 67' ' ' LEU . 1.3 tt -176.5 127.48 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.87 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.688 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 154.87 -166.5 32.46 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.437 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.8 m -118.3 145.56 44.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.854 0.359 . . . . 0.0 110.903 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -62.22 -34.54 76.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.9 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.88 -34.08 77.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.909 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -79.61 -63.98 1.29 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.942 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.5 mp . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.829 -179.982 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.63 HD23 ' HA ' ' A' ' 76' ' ' ASN . 1.7 mp . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.788 0.328 . . . . 0.0 110.825 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.96 -177.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.802 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.4 mp -132.14 107.36 12.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.167 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -105.28 167.63 9.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.654 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.8 p -135.87 157.65 46.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.172 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.44 ' HB3' ' CE1' ' A' ' 79' ' ' PHE . 59.8 p -113.86 -176.57 2.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.04 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.9 mmmt -71.16 -58.41 3.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.848 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 26.4 mttp -58.38 -30.36 66.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.876 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CZ ' HD13 ' A' ' 80' ' ' LEU . 93.3 t80 -58.66 -33.72 70.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -66.71 -43.19 84.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.954 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.1 mttt -74.36 -20.12 60.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.237 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.491 ' OD1' HD21 ' A' ' 89' ' ' LEU . 1.3 m-20 -86.47 -27.31 24.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.181 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.89 -36.74 19.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.117 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.483 ' HE3' HD11 ' A' ' 16' ' ' ILE . 1.5 pttt -58.51 -29.06 65.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.209 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.483 HD11 ' HE3' ' A' ' 15' ' ' LYS . 30.2 mm -81.46 -29.16 10.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.285 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.408 HD13 ' CD2' ' A' ' 83' ' ' LEU . 24.3 mt -82.11 -39.94 22.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.076 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.8 p -58.19 -30.44 39.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.163 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.86 -28.99 25.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.932 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -98.45 31.19 2.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.833 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.21 90.57 0.93 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.524 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.577 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 11.1 t80 -175.43 93.76 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.821 0.343 . . . . 0.0 110.863 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -69.81 167.12 17.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.849 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -92.1 -31.01 15.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.962 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.83 -34.61 73.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.577 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 3.9 pp -60.12 -35.51 75.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.938 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.473 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.2 OUTLIER -67.75 -29.71 68.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.897 179.997 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.634 ' O ' HG12 ' A' ' 31' ' ' VAL . 18.6 m-85 -82.27 -28.83 31.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.956 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.2 -32.83 19.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.037 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.464 HG12 ' HA ' ' A' ' 27' ' ' LEU . 14.7 p -68.25 -21.33 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.418 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.634 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.0 p -48.43 -29.29 2.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.437 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.02 -29.35 72.4 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.458 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -89.99 -26.74 20.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.687 0.279 . . . . 0.0 110.956 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.457 HD22 ' CD2' ' A' ' 67' ' ' LEU . 65.8 mt -63.92 -42.77 97.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.943 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.75 -35.98 70.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.067 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.0 p -76.67 -46.61 24.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.89 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.757 ' HA ' HD11 ' A' ' 40' ' ' LEU . 40.2 mt-10 59.34 48.84 9.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.919 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.407 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 2.1 mt-30 -90.27 -52.1 0.33 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.195 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.407 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 73.6 Cg_endo -83.36 -92.77 0.0 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.381 2.054 . . . . 0.0 112.823 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.757 HD11 ' HA ' ' A' ' 37' ' ' GLU . 0.5 OUTLIER 53.82 28.95 8.96 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-O 120.801 0.334 . . . . 0.0 111.025 -179.951 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.477 ' HB1' ' HE2' ' A' ' 43' ' ' LYS . . . 66.66 140.77 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.001 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.38 -40.65 2.93 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.511 2.141 . . . . 0.0 112.563 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.477 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -54.09 -42.06 68.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.114 -179.754 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.457 ' CE1' ' HG3' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -146.17 72.21 1.28 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.947 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.4 mttt -56.63 -79.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.984 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.1 t0 -178.4 140.28 0.2 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.752 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 16.9 p-80 -146.54 145.16 22.43 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo . . . . . 0 C--N 1.345 0.352 0 C-N-CA 122.499 2.133 . . . . 0.0 112.365 -179.959 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 . . . . . 0 C--O 1.23 0.041 0 CA-C-O 120.818 0.342 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -60.29 150.98 28.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.92 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 -161.91 142.91 10.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.742 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -125.82 140.31 52.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.145 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.716 ' HB2' HD22 ' A' ' 40' ' ' LEU . 31.6 p -144.31 160.29 41.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.804 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -108.31 82.19 1.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.985 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.482 HD23 ' HB2' ' A' ' 67' ' ' LEU . 3.9 pp -59.76 -33.24 71.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.823 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.573 ' HD2' HD13 ' A' ' 65' ' ' LEU . 1.0 OUTLIER -110.72 170.36 5.37 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.643 179.845 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.44 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 43.4 Cg_endo -68.43 -8.6 23.53 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.431 2.087 . . . . 0.0 112.893 -179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.816 ' O ' HD12 ' A' ' 65' ' ' LEU . 1.4 t0 -158.49 58.79 0.45 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.865 0.364 . . . . 0.0 111.038 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.816 HD12 ' O ' ' A' ' 64' ' ' ASP . 3.4 mp -151.9 150.84 30.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.054 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.692 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -119.22 106.78 12.68 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.501 179.796 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.55 HD11 HD22 ' A' ' 80' ' ' LEU . 40.0 tp -96.28 97.26 9.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.95 0.405 . . . . 0.0 111.479 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.501 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 27.6 t -94.85 123.73 47.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.062 178.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.477 ' CD1' ' CD1' ' A' ' 71' ' ' ILE . 2.4 p90 -140.8 177.71 7.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.915 0.388 . . . . 0.0 111.285 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.83 106.49 4.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.643 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.614 HG23 HD22 ' A' ' 2' ' ' LEU . 1.5 mp -84.96 137.85 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.896 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.401 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -118.01 101.72 8.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.568 179.739 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.6 ptpp? -60.19 -20.72 59.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.279 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.65 -32.01 49.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.838 0.352 . . . . 0.0 111.025 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -145.21 17.14 1.54 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.273 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.63 ' HA ' HD23 ' A' ' 2' ' ' LEU . 21.2 m120 46.92 74.46 0.15 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.789 0.328 . . . . 0.0 111.336 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.401 ' HB ' ' CG ' ' A' ' 72' ' ' LYS . 98.6 m -134.08 139.48 45.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.925 0.393 . . . . 0.0 110.955 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.06 94.36 5.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.639 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.44 ' CE1' ' HB3' ' A' ' 7' ' ' SER . 3.4 t80 -92.2 112.88 24.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.986 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.55 HD22 HD11 ' A' ' 67' ' ' LEU . 16.1 mt -71.66 171.07 12.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.707 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.501 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 92.7 t -147.65 -65.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.084 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -115.73 166.03 12.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.06 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.549 HD23 HD23 ' A' ' 65' ' ' LEU . 0.9 OUTLIER -178.92 119.73 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.885 179.899 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.692 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 143.63 -168.53 26.3 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.449 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.497 ' O ' HD23 ' A' ' 89' ' ' LEU . 8.1 t -100.32 172.59 7.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.852 0.358 . . . . 0.0 110.972 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -79.04 -40.46 31.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.857 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.7 m -74.26 -31.35 62.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.871 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.15 -31.86 70.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.85 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.497 HD23 ' O ' ' A' ' 85' ' ' SER . 3.1 mm? . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.785 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 mt . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.849 0.357 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.551 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -60.19 -175.47 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.763 -179.971 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -132.04 118.13 35.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.073 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -111.79 168.65 9.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.896 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.6 p -143.45 148.41 36.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.999 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 6.9 p -109.81 -171.1 1.77 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.903 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm -79.78 -33.92 40.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.668 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.407 ' HA ' ' CD ' ' A' ' 12' ' ' LYS . 4.5 mttp -80.5 -26.45 38.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.934 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.596 ' HZ ' HD11 ' A' ' 27' ' ' LEU . 35.9 t80 -72.01 -30.63 65.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.934 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.12 -39.38 49.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.128 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.407 ' CD ' ' HA ' ' A' ' 9' ' ' LYS . 2.2 ptmm? -75.74 -13.14 60.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.421 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -90.11 -32.33 16.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.686 0.279 . . . . 0.0 111.056 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.405 HD12 HD12 ' A' ' 83' ' ' LEU . 1.3 tp -79.48 -40.17 30.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.165 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -57.4 -23.28 48.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.234 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.9 mm -86.05 -29.86 6.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.172 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.445 HD11 ' CA ' ' A' ' 84' ' ' GLY . 4.3 mt -85.96 -34.02 20.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.934 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.3 p -60.42 -34.91 59.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.1 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.03 -46.09 58.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.844 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -73.15 -30.9 63.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.928 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 146.91 84.91 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.41 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.577 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 8.3 t80 -164.66 99.11 0.79 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.712 0.291 . . . . 0.0 110.882 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.73 166.22 11.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.843 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.3 mp -98.04 -29.99 12.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.859 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.7 -32.64 74.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.957 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.577 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 4.0 pp -59.6 -31.69 69.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.855 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.596 HD11 ' HZ ' ' A' ' 10' ' ' PHE . 0.9 OUTLIER -67.97 -26.66 66.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.066 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.679 ' O ' HG12 ' A' ' 31' ' ' VAL . 32.3 m-85 -79.76 -26.83 40.57 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.058 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.72 -29.64 19.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.16 -179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.535 HG12 ' HA ' ' A' ' 27' ' ' LEU . 14.8 p -74.25 -25.56 19.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.213 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.679 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.6 p -49.03 -29.36 2.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.333 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -67.57 -29.11 73.68 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.342 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -89.99 -32.77 16.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.911 0.386 . . . . 0.0 110.958 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 40.6 mt -68.08 -41.64 81.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.833 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.07 -40.02 94.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.118 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 68.3 p -75.67 -36.68 60.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.876 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.943 ' HA ' HD21 ' A' ' 40' ' ' LEU . 27.5 mt-10 59.8 52.54 5.36 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.863 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -96.42 -52.82 0.22 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.595 -179.772 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -81.78 -82.57 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.383 2.055 . . . . 0.0 113.238 -179.214 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.943 HD21 ' HA ' ' A' ' 37' ' ' GLU . 0.6 OUTLIER 48.69 40.72 16.43 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.895 0.378 . . . . 0.0 111.136 -179.506 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.69 132.66 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.085 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.407 ' HA ' ' HD2' ' A' ' 45' ' ' LYS . 70.1 Cg_endo -74.24 -25.26 13.72 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.497 2.131 . . . . 0.0 112.451 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.31 -28.34 38.23 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.071 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -103.19 -61.5 1.4 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.026 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.407 ' HD2' ' HA ' ' A' ' 42' ' ' PRO . 0.0 OUTLIER 63.9 140.38 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.839 -179.958 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.577 ' OD1' HD23 ' A' ' 40' ' ' LEU . 4.2 p-10 -59.7 151.17 25.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.909 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 2.4 p-80 -162.76 146.65 8.97 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo . . . . . 0 C--N 1.346 0.402 0 C-N-CA 122.462 2.108 . . . . 0.0 112.366 179.97 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.827 0.346 . . . . 0.0 110.973 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -66.0 176.01 1.83 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.009 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -177.41 130.57 0.16 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.65 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.464 ' HG3' HG22 ' A' ' 68' ' ' VAL . 24.2 tt0 -103.23 137.98 40.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.985 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 15.1 m -141.97 -176.29 4.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.83 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 25.0 m80 -143.26 93.76 2.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.914 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.999 HD22 HD12 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -70.66 -29.55 65.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.902 179.858 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.501 ' HB2' HD13 ' A' ' 65' ' ' LEU . 1.2 mttp -121.69 162.77 34.83 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.809 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.69 -12.76 32.94 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.602 2.202 . . . . 0.0 112.772 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.589 ' O ' HD12 ' A' ' 65' ' ' LEU . 20.6 t70 -148.75 65.7 1.05 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.83 0.348 . . . . 0.0 111.254 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.589 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.8 OUTLIER -163.25 149.61 12.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.025 179.886 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.71 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.3 OUTLIER -115.86 149.01 39.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.633 179.817 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.999 HD12 HD22 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -149.66 93.32 2.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.131 -179.834 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.508 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 38.7 t -95.37 69.4 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.968 0.413 . . . . 0.0 110.794 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.689 ' HD2' HD22 ' A' ' 67' ' ' LEU . 9.9 p90 -89.64 168.64 11.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.457 -179.587 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.591 ' C ' HD12 ' A' ' 71' ' ' ILE . 5.7 pt20 -137.64 141.13 41.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.692 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.591 HD12 ' C ' ' A' ' 70' ' ' GLN . 1.4 mp -108.79 119.67 58.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.792 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.408 ' HB2' ' HG2' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -93.23 99.21 11.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.655 179.831 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.3 mttp -60.73 -28.1 68.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.359 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.408 ' HG2' ' HB2' ' A' ' 72' ' ' LYS . 4.8 pt20 -52.87 -28.36 22.7 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.836 0.351 . . . . 0.0 111.149 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -139.7 10.94 2.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.558 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 46.82 76.14 0.11 Allowed 'General case' 0 N--CA 1.461 0.1 0 CA-C-O 120.838 0.351 . . . . 0.0 111.335 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.551 HG23 ' HB ' ' A' ' 3' ' ' THR . 54.8 m -139.85 150.21 44.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.933 0.397 . . . . 0.0 111.036 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.627 HD23 HG23 ' A' ' 31' ' ' VAL . 23.0 tp -107.14 93.84 4.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.434 179.747 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 4.3 t80 -89.87 107.33 19.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.841 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.557 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 1.9 mt -71.36 173.93 7.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.96 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.508 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 90.5 t -151.92 -84.55 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.203 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.492 ' CZ ' HD13 ' A' ' 66' ' ' LEU . 34.8 ttt180 -83.42 163.28 20.65 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.949 0.404 . . . . 0.0 110.771 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.458 HD13 HD23 ' A' ' 65' ' ' LEU . 1.3 tm? -175.49 95.12 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.889 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.71 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 144.25 -168.67 26.56 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.622 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.9 t -112.96 159.41 19.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.756 0.312 . . . . 0.0 110.97 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -62.43 -39.34 93.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.909 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 23.6 m -71.4 -33.22 69.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.921 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.33 -48.12 65.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.884 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.023 179.942 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.8 mmt . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 120.936 0.398 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.616 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -97.65 130.83 44.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.922 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.53 -174.5 0.55 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.872 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -130.27 114.66 29.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.992 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.65 164.49 11.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.795 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 32.7 p -134.76 151.3 50.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.943 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.411 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 8.1 t -105.29 -169.52 1.61 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.07 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.0 mtmt -81.59 -56.44 4.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.887 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.2 mtmt -58.85 -30.76 67.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.825 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -63.62 -46.52 85.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.777 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -58.73 -30.8 67.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.963 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.13 -6.04 59.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.55 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.96 -49.67 6.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.817 0.341 . . . . 0.0 111.194 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.468 HD12 HD22 ' A' ' 83' ' ' LEU . 1.3 tp -59.43 -38.3 80.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.338 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.2 ptpp? -56.96 -26.46 59.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.316 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 29.1 mm -85.19 -28.56 6.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.375 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.682 HD11 ' HA2' ' A' ' 84' ' ' GLY . 7.1 mt -86.29 -32.47 21.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.138 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 p -64.49 -31.59 54.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.06 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.14 -40.2 38.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.932 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -77.64 -39.01 46.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.943 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 156.89 89.4 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.479 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -154.56 168.1 27.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.819 0.342 . . . . 0.0 110.876 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -122.01 155.31 35.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.946 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.4 mp -83.77 -50.86 7.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.982 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.2 ttmm -65.02 -21.05 66.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.123 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.595 ' O ' HD13 ' A' ' 26' ' ' LEU . 3.2 tm? -52.85 -43.06 65.78 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.079 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.518 ' O ' HG12 ' A' ' 30' ' ' VAL . 5.8 tp -64.23 -54.24 36.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.866 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.616 ' O ' HG12 ' A' ' 31' ' ' VAL . 14.4 m-85 -62.96 -18.27 62.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.953 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -90.07 -36.99 14.57 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.185 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.518 HG12 ' O ' ' A' ' 27' ' ' LEU . 9.5 p -71.8 -20.99 20.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.451 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.616 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.5 p -49.35 -40.52 14.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.368 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.406 ' N ' HG13 ' A' ' 31' ' ' VAL . . . -59.91 -28.62 66.29 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.354 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -89.98 -22.62 21.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.791 0.329 . . . . 0.0 111.096 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.5 mt -74.5 -35.86 63.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.854 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.05 -31.33 62.83 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.282 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 65.9 p -94.43 -34.7 12.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.937 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.914 ' HA ' HD21 ' A' ' 40' ' ' LEU . 3.2 mt-10 60.1 62.17 1.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.739 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.55 -51.68 0.23 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.857 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -80.49 -80.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.337 2.025 . . . . 0.0 113.349 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.914 HD21 ' HA ' ' A' ' 37' ' ' GLU . 2.0 mm? 46.67 27.95 0.73 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.633 0.254 . . . . 0.0 111.432 -179.511 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.89 ' HB3' ' HB2' ' A' ' 44' ' ' TYR . . . 59.54 117.25 0.02 OUTLIER Pre-proline 0 CA--C 1.53 0.193 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.232 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -52.99 -41.92 68.09 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.461 2.107 . . . . 0.0 112.589 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.12 -26.76 60.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.32 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.89 ' HB2' ' HB3' ' A' ' 41' ' ' ALA . 3.5 m-85 -87.85 -66.42 0.92 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.839 0.352 . . . . 0.0 110.988 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.01 117.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.2 p-10 -56.1 157.25 4.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.061 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -162.01 155.18 17.42 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.949 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.91 -176.49 1.83 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.528 2.152 . . . . 0.0 112.286 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -114.31 -48.98 2.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.979 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.2 mttp 61.45 169.65 0.11 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.803 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 98.88 47.29 1.94 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.4 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 96.75 -30.15 9.36 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.508 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.444 ' HB3' ' CD2' ' A' ' 56' ' ' PHE . 1.8 mt -118.41 87.01 2.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.864 0.364 . . . . 0.0 110.798 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.0 ptpt -76.44 -25.24 54.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.148 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 56' ' ' PHE . 4.0 m-20 -84.34 54.75 3.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.888 0.375 . . . . 0.0 110.908 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.444 ' CD2' ' HB3' ' A' ' 53' ' ' LEU . 67.8 m-85 -157.05 122.88 4.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.851 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -143.41 139.89 30.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.719 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.481 ' HG3' HG22 ' A' ' 68' ' ' VAL . 10.8 tt0 -121.51 143.09 49.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.987 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.76 ' HB2' HD12 ' A' ' 40' ' ' LEU . 31.8 p -131.28 -174.33 3.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.693 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.445 ' CE1' HD23 ' A' ' 66' ' ' LEU . 34.8 m-70 -143.14 90.49 2.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.987 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.648 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.1 pp -59.64 -41.28 90.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.721 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.648 ' N ' HD12 ' A' ' 61' ' ' LEU . 0.5 OUTLIER -101.61 166.05 12.94 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.832 179.867 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.0 -11.86 32.9 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.561 2.174 . . . . 0.0 112.594 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.52 ' O ' HD12 ' A' ' 65' ' ' LEU . 0.8 OUTLIER -145.57 48.18 1.26 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.8 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.52 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.1 OUTLIER -156.68 132.19 9.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.168 -179.85 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.621 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -99.03 177.81 5.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.247 179.48 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.491 HD23 ' C ' ' A' ' 67' ' ' LEU . 5.7 tt -166.37 99.11 0.6 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.899 0.38 . . . . 0.0 111.403 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.481 HG22 ' HG3' ' A' ' 58' ' ' GLU . 16.4 t -90.0 136.41 23.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.115 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.879 ' HA ' HG23 ' A' ' 81' ' ' VAL . 7.3 p90 -153.03 169.69 22.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.925 0.393 . . . . 0.0 111.447 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -140.01 123.58 17.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.68 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.513 ' N ' HD13 ' A' ' 71' ' ' ILE . 2.9 mm -84.82 150.28 4.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.329 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.425 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -134.48 87.06 2.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.76 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -21.14 43.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.213 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -50.85 -31.34 16.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.753 0.311 . . . . 0.0 111.021 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -144.0 17.48 1.76 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.201 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 47.99 71.91 0.31 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.809 0.337 . . . . 0.0 111.286 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.425 ' HB ' ' CG ' ' A' ' 72' ' ' LYS . 55.4 m -138.21 145.77 41.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.022 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.616 ' HB2' HD12 ' A' ' 2' ' ' LEU . 1.0 OUTLIER -105.2 95.15 5.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.669 179.794 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.411 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.1 t80 -92.16 115.68 28.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.014 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.406 ' O ' ' CE1' ' A' ' 79' ' ' PHE . 20.0 mt -76.19 168.3 20.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.673 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.879 HG23 ' HA ' ' A' ' 69' ' ' TYR . 48.0 t -131.85 -68.94 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.086 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -128.16 167.06 17.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.951 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.468 HD22 HD12 ' A' ' 14' ' ' LEU . 9.7 tt -171.9 134.75 0.79 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.834 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.682 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 143.28 -149.51 21.44 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.581 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.8 150.08 48.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.818 0.342 . . . . 0.0 110.804 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -59.99 -43.36 95.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.824 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.7 p -70.82 -32.96 70.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.92 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.49 -56.59 6.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.861 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.0 mp -60.85 -38.96 87.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.856 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.134 -0.936 . . . . 0.0 110.884 -179.914 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 mtm . . . . . 0 N--CA 1.488 1.427 0 CA-C-O 120.791 0.329 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.448 HD23 ' HB3' ' A' ' 76' ' ' ASN . 1.4 mt -135.56 147.44 48.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.76 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.507 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -60.13 -176.47 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.829 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.444 ' N ' HD12 ' A' ' 4' ' ' ILE . 4.3 mp -128.5 113.93 31.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.171 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.425 ' O ' HD12 ' A' ' 80' ' ' LEU . 4.3 mm-40 -114.29 165.83 12.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.763 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 63.0 p -132.57 162.42 31.33 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.023 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.418 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 1.0 OUTLIER -118.64 -176.53 3.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.918 -179.948 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.68 -47.36 32.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.856 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.9 mttt -67.52 -34.56 77.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.857 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.53 ' CE2' HD13 ' A' ' 80' ' ' LEU . 60.9 t80 -63.22 -31.22 72.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -69.29 -53.38 20.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.91 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -13.33 61.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.318 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.426 ' OD2' HD21 ' A' ' 89' ' ' LEU . 0.7 OUTLIER -82.15 -29.2 31.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.774 0.321 . . . . 0.0 110.998 -179.956 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.58 -31.71 63.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.983 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.411 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -62.71 -26.48 68.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.058 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.1 mm -81.48 -29.74 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.21 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.696 HD21 ' HA2' ' A' ' 84' ' ' GLY . 3.3 mm? -84.51 -36.25 22.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.081 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.411 HG12 ' HA ' ' A' ' 15' ' ' LYS . 11.8 p -63.81 -33.75 63.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.133 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.7 tptt -71.23 -36.35 71.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -87.6 -24.25 24.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.961 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 138.3 94.69 0.32 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.354 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.836 ' CE1' HD11 ' A' ' 26' ' ' LEU . 50.5 t80 -167.64 125.56 1.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.82 0.343 . . . . 0.0 110.988 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.479 ' C ' HD22 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -94.95 -176.44 3.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.7 -179.98 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.507 ' N ' HD22 ' A' ' 24' ' ' LEU . 3.5 mm? -111.73 -32.14 6.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.95 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.57 -29.87 68.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.957 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.836 HD11 ' CE1' ' A' ' 22' ' ' PHE . 4.2 pp -72.9 -31.33 64.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.992 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.616 HD12 ' CZ ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -72.67 -26.48 61.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.023 179.976 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.497 ' O ' HG12 ' A' ' 31' ' ' VAL . 6.7 m-85 -86.3 -29.31 23.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.897 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.19 -32.53 19.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.969 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.6 p -62.21 -18.56 20.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.267 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.497 HG12 ' O ' ' A' ' 28' ' ' TYR . 11.6 p -50.97 -43.41 25.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.755 0.312 . . . . 0.0 111.26 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.463 ' N ' HG13 ' A' ' 31' ' ' VAL . . . -59.19 -28.12 63.71 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.355 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.7 m-20 -89.96 -24.26 21.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.796 0.331 . . . . 0.0 111.006 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 68.4 mt -72.51 -34.01 67.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.942 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.96 -39.06 30.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.232 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.0 p -83.88 -38.99 20.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.886 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.749 ' HB3' HD11 ' A' ' 40' ' ' LEU . 8.4 mt-10 59.71 66.69 0.96 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.925 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.403 ' CB ' ' HD3' ' A' ' 39' ' ' PRO . 0.5 OUTLIER -94.56 -53.11 0.24 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.16 -179.912 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.403 ' HD3' ' CB ' ' A' ' 38' ' ' GLN . 60.8 Cg_endo -85.82 -88.97 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.611 2.207 . . . . 0.0 112.81 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.749 HD11 ' HB3' ' A' ' 37' ' ' GLU . 0.4 OUTLIER 59.32 21.25 9.49 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.67 0.272 . . . . 0.0 111.038 -179.898 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.642 ' HB1' ' HE3' ' A' ' 43' ' ' LYS . . . 63.31 128.73 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.002 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.17 -23.55 21.08 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.426 2.084 . . . . 0.0 112.476 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.642 ' HE3' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.35 -30.63 42.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.069 -179.954 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -101.56 -58.04 1.96 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.077 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.7 mttt 62.52 149.64 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.883 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -92.13 161.47 14.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.87 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -159.25 158.73 28.64 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.914 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.45 ' HA ' ' HB3' ' A' ' 57' ' ' ARG . 68.2 Cg_endo -74.38 -4.14 14.94 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.654 2.236 . . . . 0.0 112.787 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.451 HD12 ' HA ' ' A' ' 57' ' ' ARG . 0.2 OUTLIER 75.03 -60.23 0.52 Allowed 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.785 0.326 . . . . 0.0 110.988 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.8 mttm 64.76 173.25 0.2 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.871 0.367 . . . . 0.0 110.918 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 96.35 36.28 5.2 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.312 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.81 -30.64 9.7 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.49 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 11.2 mt -119.9 68.84 0.84 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.877 0.37 . . . . 0.0 110.829 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -67.96 -31.15 70.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.862 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.78 -34.16 77.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.833 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -84.86 138.79 32.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.868 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.451 ' HA ' HD12 ' A' ' 49' ' ' LEU . 0.5 OUTLIER -156.73 155.21 31.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.887 -179.934 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.547 ' HB2' HG22 ' A' ' 68' ' ' VAL . 33.3 tt0 -130.15 133.87 46.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.972 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 28.9 p -119.09 -172.04 2.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.798 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.1 m80 -140.5 79.9 1.73 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.887 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.504 ' CD2' HD12 ' A' ' 67' ' ' LEU . 1.1 pp -55.91 -50.63 70.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.866 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.489 ' N ' HD12 ' A' ' 61' ' ' LEU . 6.7 mttt -95.15 167.69 12.43 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.705 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 38.2 Cg_endo -66.66 -12.78 37.25 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.545 2.163 . . . . 0.0 112.604 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.855 ' O ' HD12 ' A' ' 65' ' ' LEU . 5.9 t70 -150.92 51.74 0.86 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.677 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.855 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.4 OUTLIER -156.5 130.47 8.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.065 -179.823 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.467 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -104.21 160.92 14.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.295 179.555 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.504 HD12 ' CD2' ' A' ' 61' ' ' LEU . 5.1 tt -148.78 102.62 3.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.854 0.359 . . . . 0.0 111.344 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.547 HG22 ' HB2' ' A' ' 58' ' ' GLU . 25.7 t -90.01 128.78 41.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.231 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.804 ' HA ' HG23 ' A' ' 81' ' ' VAL . 12.1 p90 -150.08 165.94 31.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.909 0.385 . . . . 0.0 111.13 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -145.95 124.38 12.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.858 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.569 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -90.39 151.85 3.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.893 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.414 ' HB2' ' CG ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -120.62 104.0 9.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.733 179.758 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.76 -24.53 64.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.374 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.414 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 1.5 pt20 -53.22 -33.9 54.81 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.089 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -142.95 15.5 1.92 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.444 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.448 ' HB3' HD23 ' A' ' 2' ' ' LEU . 6.9 m-20 46.12 74.32 0.15 Allowed 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.78 0.324 . . . . 0.0 111.332 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.507 HG23 ' HB ' ' A' ' 3' ' ' THR . 98.8 m -136.08 140.34 43.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.933 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.512 HD21 ' CD2' ' A' ' 69' ' ' TYR . 0.6 OUTLIER -95.82 90.51 5.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.686 179.919 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.418 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 2.9 t80 -90.0 106.94 18.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.916 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.53 HD13 ' CE2' ' A' ' 10' ' ' PHE . 3.4 mt -64.53 169.46 4.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.767 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.804 HG23 ' HA ' ' A' ' 69' ' ' TYR . 42.5 t -131.86 -69.81 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.174 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.8 mmm-85 -132.98 178.57 6.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.847 0.356 . . . . 0.0 111.101 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.41 HD12 ' HG ' ' A' ' 67' ' ' LEU . 7.7 tt -177.89 144.34 0.35 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.93 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.696 ' HA2' HD21 ' A' ' 17' ' ' LEU . . . 139.72 -131.72 5.28 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.576 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 39.3 t -147.98 147.12 29.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.769 0.319 . . . . 0.0 110.938 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -59.69 -30.95 69.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.838 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.2 m -78.87 -37.04 41.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.87 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -68.52 -55.43 11.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.854 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.426 HD21 ' OD2' ' A' ' 13' ' ' ASP . 4.3 mp -63.84 -72.3 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.862 179.934 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.5 ttm . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.871 0.367 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.622 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -99.0 131.86 44.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.838 179.921 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.493 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -57.73 -177.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.039 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.9 mp -131.64 130.43 62.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.055 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -121.57 165.94 14.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.803 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 43.1 p -127.43 160.14 32.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.026 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.421 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 0.5 OUTLIER -117.32 -176.37 2.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.912 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 ptpt -76.78 -47.14 22.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.857 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.7 mtpt -67.96 -31.18 70.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.775 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.709 ' CE1' HD23 ' A' ' 14' ' ' LEU . 56.2 t80 -59.65 -39.36 84.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.87 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.85 -34.51 78.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.939 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 mttm -78.54 -24.73 45.5 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.158 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.556 ' OD1' HD11 ' A' ' 89' ' ' LEU . 3.8 m-20 -87.72 -28.58 21.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.109 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.709 HD23 ' CE1' ' A' ' 10' ' ' PHE . 0.1 OUTLIER -80.37 -28.41 38.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.14 -179.832 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 11.8 pttt -70.83 -28.53 64.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.267 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 28.4 mm -83.21 -45.17 18.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.312 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.545 HD12 HD13 ' A' ' 83' ' ' LEU . 5.4 mt -63.07 -40.35 97.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.012 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.433 HG12 ' O ' ' A' ' 14' ' ' LEU . 11.7 p -64.27 -29.85 48.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.106 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -77.33 -37.51 52.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.903 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -82.24 -49.25 10.3 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.899 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 170.26 89.44 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.486 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.848 ' CE1' HD11 ' A' ' 26' ' ' LEU . 56.0 t80 -174.34 151.69 1.65 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.859 0.362 . . . . 0.0 110.856 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -126.7 159.2 34.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.908 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -89.46 -29.42 19.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.005 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -58.31 -41.49 84.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.896 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.848 HD11 ' CE1' ' A' ' 22' ' ' PHE . 3.9 pp -66.45 -31.34 72.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.861 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.526 ' HA ' HG12 ' A' ' 30' ' ' VAL . 5.3 tt -66.77 -28.37 68.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.041 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.549 ' O ' HG12 ' A' ' 31' ' ' VAL . 0.3 OUTLIER -78.84 -30.05 45.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.939 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -84.28 -35.58 23.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.065 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.526 HG12 ' HA ' ' A' ' 27' ' ' LEU . 14.6 p -69.63 -11.95 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.499 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.549 HG12 ' O ' ' A' ' 28' ' ' TYR . 11.7 p -50.83 -41.57 21.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.858 0.361 . . . . 0.0 111.261 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.418 ' N ' HG13 ' A' ' 31' ' ' VAL . . . -69.68 -28.37 72.23 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.297 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -84.66 -19.91 32.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.715 0.293 . . . . 0.0 111.21 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.524 HD21 ' CD2' ' A' ' 61' ' ' LEU . 79.3 mt -70.88 -45.38 64.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.798 0.332 . . . . 0.0 110.956 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.22 -50.17 66.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.242 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.8 p -75.26 -37.05 61.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.928 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 61.09 54.69 3.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.903 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.451 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 3.5 mt-30 -79.42 -52.59 1.13 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.31 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.451 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 56.0 Cg_endo -73.09 -88.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.065 1.843 . . . . 0.0 112.544 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.0 mp 51.95 -178.49 0.02 OUTLIER 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.758 0.313 . . . . 0.0 111.077 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.4 ' HB3' ' CD2' ' A' ' 44' ' ' TYR . . . -122.17 114.74 30.54 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.161 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.13 71.1 2.27 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.5 2.133 . . . . 0.0 112.299 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.4 ' HD3' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -168.75 -41.0 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.959 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.423 ' HB2' ' CG ' ' A' ' 60' ' ' HIS . 16.2 m-85 -85.54 5.47 31.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.42 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp 62.52 145.98 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.888 0.375 . . . . 0.0 110.978 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -156.04 109.3 2.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.874 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.439 ' CG ' ' HD2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -169.8 167.01 5.31 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.744 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.439 ' HD2' ' CG ' ' A' ' 47' ' ' HIS . 43.1 Cg_endo -68.11 -176.11 0.97 Allowed 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.514 2.143 . . . . 0.0 112.306 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.8 mt -127.13 -176.02 3.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.868 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -150.97 177.5 10.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.929 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.2 55.39 3.75 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.503 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 95.08 -20.47 49.05 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.678 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.1 mt -119.55 92.27 3.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.798 0.332 . . . . 0.0 110.989 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.4 mtpp -97.1 -45.46 6.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.884 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -69.79 -22.96 63.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.155 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -69.28 133.09 47.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.009 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 21.4 mtp180 -150.75 150.83 31.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.743 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -139.17 120.87 15.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.883 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.1 p -127.82 150.78 49.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.875 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.423 ' CG ' ' HB2' ' A' ' 44' ' ' TYR . 10.8 m-70 -102.44 78.43 1.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.999 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.728 HD12 ' HG2' ' A' ' 62' ' ' LYS . 2.2 pp -58.99 -33.25 70.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.974 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.728 ' HG2' HD12 ' A' ' 61' ' ' LEU . 1.1 mmmm -127.61 159.66 64.78 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.713 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.54 122.71 12.12 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.649 2.232 . . . . 0.0 112.273 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 61.7 39.85 13.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.971 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -138.36 104.04 5.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.914 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.688 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -95.72 123.28 39.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.554 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.967 HD21 HD12 ' A' ' 80' ' ' LEU . 7.9 tt -117.82 99.51 6.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.945 0.402 . . . . 0.0 111.168 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.561 HG23 ' HB3' ' A' ' 82' ' ' ARG . 16.3 t -89.79 138.68 18.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.081 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.628 ' HA ' HG23 ' A' ' 81' ' ' VAL . 40.0 p90 -147.09 -178.07 6.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.086 0.469 . . . . 0.0 111.57 -179.39 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -162.1 111.45 1.49 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.574 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.542 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -84.7 146.62 6.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.058 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.06 103.95 11.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.742 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.08 -22.21 26.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.328 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -47.49 -36.65 10.54 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.289 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -148.26 21.03 1.08 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.268 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 26.4 m-20 48.27 71.92 0.31 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.914 0.387 . . . . 0.0 111.117 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.493 HG23 ' HB ' ' A' ' 3' ' ' THR . 99.7 m -128.71 147.54 50.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.911 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.622 ' HB2' HD12 ' A' ' 2' ' ' LEU . 0.7 OUTLIER -102.5 92.63 4.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.727 179.844 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.421 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 2.1 t80 -91.19 102.7 15.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.872 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.967 HD12 HD21 ' A' ' 67' ' ' LEU . 3.6 mm? -63.65 167.21 6.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.716 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.628 HG23 ' HA ' ' A' ' 69' ' ' TYR . 59.3 t -137.92 -66.62 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.971 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.561 ' HB3' HG23 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -114.39 163.34 15.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.974 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.766 HD23 HD12 ' A' ' 67' ' ' LEU . 3.1 tm? -176.38 91.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.826 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.688 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 172.53 -152.29 16.31 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.667 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.3 t -127.0 141.71 51.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.856 0.36 . . . . 0.0 110.805 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -59.39 -30.16 68.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.891 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.15 -31.47 30.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.906 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -69.12 -48.86 61.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.923 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.556 HD11 ' OD1' ' A' ' 13' ' ' ASP . 3.6 mp -59.24 -31.2 68.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.882 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.307 -0.854 . . . . 0.0 110.848 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.844 0.354 . . . . 0.0 111.099 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.529 HD23 ' HA ' ' A' ' 76' ' ' ASN . 2.6 mp -145.12 146.06 31.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.823 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.465 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -59.45 -177.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.836 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.9 mp -128.76 123.01 58.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.039 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -121.05 166.02 14.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.79 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 41.3 p -134.4 150.72 50.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.985 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.414 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 2.6 t -105.49 178.32 4.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.005 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.21 -47.11 65.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.807 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -68.46 -31.94 71.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.742 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.539 ' CZ ' HD13 ' A' ' 80' ' ' LEU . 85.2 t80 -64.02 -41.84 97.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.892 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -60.3 -52.71 64.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.935 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.2 ptmt -69.71 -12.41 61.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.26 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.659 ' OD1' HD21 ' A' ' 89' ' ' LEU . 1.8 m-20 -90.05 -24.22 21.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.247 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.925 HD23 HD11 ' A' ' 24' ' ' LEU . 1.2 tp -89.97 -44.68 9.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.384 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.455 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -53.51 -24.64 13.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.413 -179.571 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 29.4 mm -80.67 -28.88 11.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.223 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.71 HD11 ' HA2' ' A' ' 84' ' ' GLY . 25.3 mt -87.06 -38.4 16.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.071 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.545 HG23 ' HA ' ' A' ' 23' ' ' ASP . 12.1 p -59.05 -40.32 80.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.04 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -30.0 69.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.836 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -100.64 28.26 5.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.888 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.68 102.79 0.55 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.673 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.405 ' HB3' ' HA ' ' A' ' 18' ' ' VAL . 53.5 t80 -175.67 -40.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.713 0.292 . . . . 0.0 110.878 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.545 ' HA ' HG23 ' A' ' 18' ' ' VAL . 0.5 OUTLIER 59.41 173.9 0.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.912 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.925 HD11 HD23 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -117.86 17.05 14.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.081 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.02 -33.54 16.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.875 0.369 . . . . 0.0 110.871 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.78 HD12 ' N ' ' A' ' 27' ' ' LEU . 4.3 pp -64.66 -29.62 70.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.977 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.78 ' N ' HD12 ' A' ' 26' ' ' LEU . 3.3 tp -71.75 -36.36 70.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.903 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.488 ' O ' HG22 ' A' ' 31' ' ' VAL . 5.1 m-85 -76.47 -27.65 56.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.874 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.84 -31.57 20.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.986 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.583 HG12 ' O ' ' A' ' 26' ' ' LEU . 14.7 p -78.36 -5.0 7.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.614 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.488 HG22 ' O ' ' A' ' 28' ' ' TYR . 30.0 m -53.03 -42.91 46.41 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-O 120.89 0.376 . . . . 0.0 111.361 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.434 ' N ' HG23 ' A' ' 31' ' ' VAL . . . -63.85 -26.98 70.52 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.432 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.2 m-20 -85.61 -22.4 28.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.632 0.253 . . . . 0.0 111.129 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 75.2 mt -76.54 -48.64 18.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.902 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.09 -36.02 82.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.213 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.5 p -88.16 -42.69 12.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.985 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.629 ' HA ' HD11 ' A' ' 40' ' ' LEU . 15.4 mt-10 61.88 57.29 2.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.876 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -88.72 -51.89 0.38 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.412 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -79.95 -92.93 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.221 1.947 . . . . 0.0 112.703 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.629 HD11 ' HA ' ' A' ' 37' ' ' GLU . 1.0 OUTLIER 55.86 -178.24 0.04 OUTLIER 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.826 0.346 . . . . 0.0 111.074 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.544 ' HB3' ' HD2' ' A' ' 44' ' ' TYR . . . -128.32 106.46 19.47 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.04 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.97 -7.14 20.76 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.425 2.083 . . . . 0.0 112.793 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.2 32.0 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.697 0.284 . . . . 0.0 111.013 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.544 ' HD2' ' HB3' ' A' ' 41' ' ' ALA . 18.1 m-85 -139.95 -79.66 0.3 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.932 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -177.98 37.67 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.922 0.391 . . . . 0.0 110.893 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.405 ' O ' ' CG ' ' A' ' 47' ' ' HIS . 43.3 p-10 -71.99 75.14 0.92 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.876 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.405 ' CG ' ' O ' ' A' ' 46' ' ' ASP . 1.4 m-70 -178.16 170.0 0.89 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.905 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -52.33 -176.04 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.599 2.199 . . . . 0.0 112.231 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.509 ' N ' HD12 ' A' ' 49' ' ' LEU . 4.6 mp -109.02 -75.12 0.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.944 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.9 mtmt 174.01 -172.95 0.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.903 0.382 . . . . 0.0 110.744 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 87.16 -149.23 21.93 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.457 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.27 30.91 3.1 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.54 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.3 mp -93.52 -46.51 7.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.836 0.351 . . . . 0.0 110.887 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.87 29.37 18.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.888 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.91 -41.52 2.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.72 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -80.61 129.32 34.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.855 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -148.22 133.31 18.26 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.728 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.555 ' HG3' HG22 ' A' ' 68' ' ' VAL . 3.8 tt0 -109.76 146.37 35.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.97 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 21.2 m -149.69 141.95 24.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.772 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.533 ' CE1' HD23 ' A' ' 66' ' ' LEU . 10.0 m-70 -101.97 92.72 4.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.008 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.596 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.0 pp -62.2 -39.88 94.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.755 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.612 ' HD3' HD13 ' A' ' 65' ' ' LEU . 4.1 mttp -104.53 169.14 7.54 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.741 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 56.8 Cg_endo -71.1 -7.91 22.41 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.559 2.172 . . . . 0.0 112.95 -179.7 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.712 ' C ' HD12 ' A' ' 65' ' ' LEU . 1.1 m-20 -150.6 45.01 0.86 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.864 0.364 . . . . 0.0 111.156 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.712 HD12 ' C ' ' A' ' 64' ' ' ASP . 5.3 mp -158.91 130.21 6.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.152 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.673 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -94.24 -179.41 4.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.28 179.532 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.833 HD21 HD23 ' A' ' 80' ' ' LEU . 6.4 tt -170.09 102.24 0.29 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.836 0.35 . . . . 0.0 111.383 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.555 HG22 ' HG3' ' A' ' 58' ' ' GLU . 22.8 t -95.23 137.33 23.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.444 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.617 ' HA ' HG23 ' A' ' 81' ' ' VAL . 6.1 p90 -147.05 170.55 16.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.982 0.42 . . . . 0.0 111.405 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -143.03 114.2 7.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.553 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.488 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.4 mp -84.89 135.52 24.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.933 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.98 103.79 12.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.85 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.77 -19.85 62.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.153 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -51.65 -36.51 46.45 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.861 0.362 . . . . 0.0 111.042 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -144.99 18.56 1.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.193 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.529 ' HA ' HD23 ' A' ' 2' ' ' LEU . 12.8 m120 47.27 77.24 0.09 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.829 0.347 . . . . 0.0 111.188 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.465 HG23 ' HB ' ' A' ' 3' ' ' THR . 63.7 m -137.39 144.04 42.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.102 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.47 HD13 HD11 ' A' ' 71' ' ' ILE . 38.1 tp -98.61 91.09 4.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.451 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.414 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.1 t80 -89.8 105.82 18.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.888 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.833 HD23 HD21 ' A' ' 67' ' ' LEU . 3.0 mt -64.75 169.26 5.22 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.774 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.617 HG23 ' HA ' ' A' ' 69' ' ' TYR . 74.7 t -136.8 -71.48 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.086 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -118.67 168.44 10.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.932 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.452 HD22 HD12 ' A' ' 14' ' ' LEU . 5.5 tt -176.61 117.37 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.923 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.71 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 158.14 -147.86 16.32 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.497 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.8 136.89 29.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.821 0.343 . . . . 0.0 110.917 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.38 -30.4 66.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.909 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.7 p -76.75 -30.77 56.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.859 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -80.27 -54.84 5.36 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.927 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.659 HD21 ' OD1' ' A' ' 13' ' ' ASP . 4.5 mp -60.09 -64.92 0.78 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.772 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.821 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.791 0.329 . . . . 0.0 111.115 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.5 mp -131.91 158.06 42.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.926 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.663 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -68.76 -173.41 0.46 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.792 179.986 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.0 mp -130.2 136.76 57.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.075 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -139.63 161.09 38.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.753 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.6 p -135.36 155.43 50.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.082 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 8.7 p -110.89 -168.7 1.34 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.795 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -81.14 -42.47 20.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.942 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 71.0 mttt -72.25 -41.05 67.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.892 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.808 ' CE1' HD21 ' A' ' 14' ' ' LEU . 14.2 t80 -59.86 -34.39 73.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.805 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -65.61 -31.12 71.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.6 mtpp -87.36 -8.04 57.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.389 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.608 ' CG ' HD21 ' A' ' 89' ' ' LEU . 3.8 m-20 -88.98 -29.48 19.48 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.792 0.329 . . . . 0.0 111.128 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.808 HD21 ' CE1' ' A' ' 10' ' ' PHE . 21.9 mt -84.08 -35.3 23.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.076 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.402 ' HE3' HD11 ' A' ' 16' ' ' ILE . 27.7 pttt -58.7 -29.85 66.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.172 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.402 HD11 ' HE3' ' A' ' 15' ' ' LYS . 29.3 mm -79.89 -39.16 19.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.282 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.57 ' CD2' HD21 ' A' ' 65' ' ' LEU . 3.6 mp -72.31 -41.04 67.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.014 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.407 HG12 ' O ' ' A' ' 14' ' ' LEU . 13.6 p -63.74 -30.14 49.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.232 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -76.55 -33.9 58.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.824 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -83.15 -59.27 2.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.765 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -170.07 63.11 0.17 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.378 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.42 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 1.3 t80 -151.21 172.09 16.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.81 0.338 . . . . 0.0 110.89 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -151.42 144.1 24.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.826 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.0 mp -71.25 -23.78 62.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.043 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -51.73 68.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.073 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.42 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 2.4 pp -58.75 -31.75 68.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.007 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.508 ' HA ' HG12 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -63.24 -31.24 72.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.894 179.914 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -80.72 -26.65 37.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.7 mtpp -87.57 -29.41 21.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.973 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.508 HG12 ' HA ' ' A' ' 27' ' ' LEU . 14.8 p -76.12 -16.88 15.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.471 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.8 t -48.39 -42.06 11.6 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 120.83 0.348 . . . . 0.0 111.356 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.83 -27.5 64.39 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.339 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.9 m-20 -85.32 -22.44 28.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.819 0.343 . . . . 0.0 111.039 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.6 mt -74.26 -33.4 63.28 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.85 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.88 -43.27 62.72 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.087 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 73.3 p -86.26 -39.29 16.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.87 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 60.85 67.96 0.78 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.846 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.93 -53.57 0.26 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.255 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -82.82 -86.58 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 122.287 1.991 . . . . 0.0 112.545 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.45 ' N ' HD12 ' A' ' 40' ' ' LEU . 6.8 mp 55.38 39.44 31.2 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.786 0.327 . . . . 0.0 111.148 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 60.54 100.31 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.206 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.35 62.24 2.73 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.465 2.11 . . . . 0.0 112.404 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.12 -44.6 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.967 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -82.33 -29.68 30.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.9 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.3 mmpp? 62.08 118.7 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.032 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -81.94 154.73 25.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.716 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 12.3 p80 177.09 156.72 0.46 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.869 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.05 159.09 45.04 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.621 2.214 . . . . 0.0 112.419 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.2 mt -65.26 -67.22 0.46 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.848 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.668 ' HB2' HD11 ' A' ' 53' ' ' LEU . 7.8 mttm -146.12 104.34 3.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.95 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -65.91 123.6 24.48 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.515 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 111.9 33.16 2.26 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.584 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.668 HD11 ' HB2' ' A' ' 50' ' ' LYS . 0.9 OUTLIER -177.76 -39.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.815 0.341 . . . . 0.0 110.981 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.584 ' HG3' HD12 ' A' ' 53' ' ' LEU . 83.3 mttt -134.45 138.0 44.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.92 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -98.39 28.47 4.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.999 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.514 ' CE2' HG21 ' A' ' 81' ' ' VAL . 1.8 m-85 -80.72 174.42 11.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.827 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -175.53 125.73 0.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.837 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -116.03 130.56 56.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.782 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.65 ' SG ' HD23 ' A' ' 67' ' ' LEU . 28.5 p -134.3 -175.68 3.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.971 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 78.9 m80 -134.67 80.37 1.85 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.014 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.808 HD23 HD22 ' A' ' 67' ' ' LEU . 3.3 pp -57.34 -31.24 65.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.122 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.414 ' HB2' HD12 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -135.6 151.63 74.78 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.984 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -51.81 133.31 44.84 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.522 2.148 . . . . 0.0 112.34 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 59.41 25.55 14.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.011 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.57 HD21 ' CD2' ' A' ' 17' ' ' LEU . 3.3 mp -134.35 117.28 16.19 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.787 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.71 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.1 OUTLIER -90.03 179.35 5.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.717 -179.968 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.966 HD11 HD12 ' A' ' 80' ' ' LEU . 37.8 tp -167.39 100.35 0.51 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.372 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' A' ' 81' ' ' VAL . 41.4 t -95.3 123.33 47.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.893 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.421 ' HA ' HG23 ' A' ' 81' ' ' VAL . 10.3 p90 -138.78 159.5 41.97 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.976 0.417 . . . . 0.0 111.463 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -136.96 118.28 14.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.519 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.489 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.4 mp -84.94 123.63 39.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.921 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.401 ' CD ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -97.03 100.52 12.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.699 179.703 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.89 -22.62 38.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.112 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -49.57 -36.06 22.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.844 0.354 . . . . 0.0 111.049 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -145.39 18.29 1.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.257 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 47.23 71.01 0.35 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.804 0.335 . . . . 0.0 111.217 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.663 HG23 ' HB ' ' A' ' 3' ' ' THR . 97.6 m -130.19 148.68 52.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.065 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.418 ' CD1' HD11 ' A' ' 71' ' ' ILE . 65.0 tp -102.13 90.5 3.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.541 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.432 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 3.5 t80 -89.93 115.77 27.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.017 -179.635 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.966 HD12 HD11 ' A' ' 67' ' ' LEU . 3.3 mm? -68.97 168.14 14.35 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.706 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.514 HG21 ' CE2' ' A' ' 56' ' ' PHE . 43.9 t -141.0 -58.75 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.98 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 41.5 mmm-85 -131.54 165.49 23.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.842 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.873 HD12 HD13 ' A' ' 67' ' ' LEU . 5.9 tt -177.05 139.1 0.26 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.948 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.71 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 118.85 -143.35 17.39 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.59 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.9 t -127.4 147.74 50.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.806 0.336 . . . . 0.0 110.861 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -59.3 -30.78 68.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.915 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.3 m -87.22 -31.52 20.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -67.7 -31.4 71.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.9 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.608 HD21 ' CG ' ' A' ' 13' ' ' ASP . 0.3 OUTLIER -60.12 -64.16 1.05 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 179.924 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.226 -0.892 . . . . 0.0 110.866 179.999 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.905 0.383 . . . . 0.0 111.223 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.506 ' N ' HD12 ' A' ' 2' ' ' LEU . 0.6 OUTLIER -122.87 141.51 51.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.008 -180.0 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.481 HG22 ' H ' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -56.81 -170.45 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.863 179.872 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.481 ' H ' HG22 ' A' ' 3' ' ' THR . 4.0 mp -130.97 136.22 58.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.89 0.376 . . . . 0.0 111.187 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -128.31 170.05 13.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.644 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.6 p -137.68 165.66 25.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.854 0.359 . . . . 0.0 111.075 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.3 -175.3 3.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.913 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.13 -53.08 13.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.964 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -62.41 -36.29 81.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.913 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -59.56 -33.17 71.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.93 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -70.57 -40.6 73.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.849 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.1 mttt -78.31 -4.94 50.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.337 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.488 ' OD1' HD11 ' A' ' 89' ' ' LEU . 1.6 m-20 -90.08 -56.54 3.18 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.829 0.347 . . . . 0.0 111.173 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -54.67 -36.8 65.0 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.224 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.8 ptpt -58.9 -30.29 67.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.998 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.1 mm -82.58 -30.48 9.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.249 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.429 HD11 ' HA2' ' A' ' 84' ' ' GLY . 69.5 mt -81.78 -39.5 24.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.949 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.7 p -59.74 -33.47 52.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.08 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.1 tttp -78.88 -30.06 44.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.991 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -98.33 29.07 3.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.93 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.09 95.42 0.89 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.603 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.685 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 15.6 t80 -176.66 101.52 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.837 0.351 . . . . 0.0 110.956 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.598 ' C ' HD22 ' A' ' 24' ' ' LEU . 1.9 t0 -60.2 -167.87 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.863 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.598 HD22 ' C ' ' A' ' 23' ' ' ASP . 3.8 mm? -118.7 -39.92 2.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.997 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.3 mttp -66.67 -27.06 67.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.181 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.89 ' O ' HG23 ' A' ' 30' ' ' VAL . 3.9 pp -57.92 -41.85 83.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.045 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.725 ' O ' HG13 ' A' ' 31' ' ' VAL . 2.8 tp -64.46 -30.05 71.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.038 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.655 ' O ' HG22 ' A' ' 31' ' ' VAL . 17.7 m-85 -73.37 -27.63 61.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.144 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.86 -30.63 18.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.054 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.89 HG23 ' O ' ' A' ' 26' ' ' LEU . 34.8 t -75.01 -18.06 16.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.384 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.725 HG13 ' O ' ' A' ' 27' ' ' LEU . 28.1 m -49.47 -27.97 3.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.828 0.347 . . . . 0.0 111.441 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.555 ' O ' HG23 ' A' ' 36' ' ' THR . . . -72.34 -27.39 69.92 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.606 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -86.97 -28.53 22.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.759 0.314 . . . . 0.0 111.077 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.477 HD22 HD13 ' A' ' 67' ' ' LEU . 36.3 mt -65.11 -44.61 88.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.981 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.84 -35.96 67.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.32 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.555 HG23 ' O ' ' A' ' 32' ' ' GLY . 78.0 p -77.24 -45.12 27.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.887 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.516 ' HB3' HD11 ' A' ' 40' ' ' LEU . 18.5 mt-10 60.81 55.97 3.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.794 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.409 ' N ' ' CD ' ' A' ' 39' ' ' PRO . 0.1 OUTLIER -91.72 -52.22 0.29 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.097 -179.799 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.409 ' CD ' ' N ' ' A' ' 38' ' ' GLN . 47.2 Cg_endo -83.48 -78.31 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.422 2.081 . . . . 0.0 112.736 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.593 HD22 ' HB2' ' A' ' 59' ' ' CYS . 0.9 OUTLIER 57.7 24.75 10.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.728 0.299 . . . . 0.0 111.01 -179.89 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.24 138.52 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.096 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.71 -20.88 15.1 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.583 2.189 . . . . 0.0 112.538 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.442 ' HG2' ' CD2' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -97.67 31.58 2.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.11 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.442 ' CD2' ' HG2' ' A' ' 43' ' ' LYS . 72.5 m-85 -157.92 -70.88 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.066 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 5.9 mmmt 63.55 139.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.933 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -73.58 161.94 29.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.939 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -165.08 154.26 11.23 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.867 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.17 160.07 43.83 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.57 2.18 . . . . 0.0 112.324 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.533 HD13 ' HB3' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -97.59 -58.86 1.9 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.836 -179.882 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.8 mtmt -128.87 157.32 41.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.972 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -95.67 122.9 7.46 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.45 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 135.81 -29.15 2.89 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.453 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -131.91 -47.26 0.94 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.806 0.336 . . . . 0.0 110.871 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.7 mttt 58.17 30.38 19.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.912 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.18 -47.94 22.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.842 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.533 ' HB3' HD13 ' A' ' 49' ' ' LEU . 4.8 m-85 -87.68 147.92 25.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.765 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -160.79 147.0 14.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.95 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.631 ' OE2' HD22 ' A' ' 66' ' ' LEU . 54.0 tt0 -127.48 117.63 22.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.933 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.593 ' HB2' HD22 ' A' ' 40' ' ' LEU . 30.3 p -115.02 177.48 4.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.843 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -124.05 90.05 3.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.893 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.882 HD23 HD12 ' A' ' 67' ' ' LEU . 3.8 pp -65.82 -32.43 73.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.883 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.511 ' HB2' HD12 ' A' ' 61' ' ' LEU . 1.4 mttp -139.16 165.18 33.89 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.809 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -62.01 130.58 31.38 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.54 2.16 . . . . 0.0 112.153 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 61.14 31.03 19.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.839 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -140.14 118.16 11.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.812 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.7 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -97.6 177.64 5.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.616 179.916 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.96 HD21 HD12 ' A' ' 80' ' ' LEU . 3.9 tt -165.37 102.35 0.73 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.12 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.409 ' O ' ' N ' ' A' ' 81' ' ' VAL . 37.5 t -94.65 124.16 47.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.167 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.653 ' HD2' HD22 ' A' ' 67' ' ' LEU . 5.6 p90 -141.18 157.94 44.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.933 0.397 . . . . 0.0 111.244 -179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -137.26 114.04 10.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.75 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.502 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.3 mp -84.98 131.99 32.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.88 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.424 ' HB2' ' CG ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -106.55 102.42 11.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.801 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.1 mttp -59.33 -23.43 62.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.491 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.424 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 1.1 pt20 -51.26 -33.49 28.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.73 0.3 . . . . 0.0 111.141 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -145.51 17.2 1.49 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.482 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 m120 46.53 72.61 0.22 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.894 0.378 . . . . 0.0 111.256 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.411 ' HB ' ' CG ' ' A' ' 72' ' ' LYS . 85.1 m -131.18 142.93 50.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.921 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.435 ' CD1' HD11 ' A' ' 71' ' ' ILE . 64.4 tp -97.06 90.29 5.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.525 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -91.68 106.35 18.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.899 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.96 HD12 HD21 ' A' ' 67' ' ' LEU . 3.6 mm? -65.43 -177.57 0.43 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.675 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.409 ' N ' ' O ' ' A' ' 68' ' ' VAL . 45.6 t -153.25 -62.99 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.165 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -127.54 166.49 17.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.868 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.568 HD12 ' HG ' ' A' ' 67' ' ' LEU . 1.4 tt -178.26 132.6 0.14 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.856 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.7 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 129.76 -145.82 16.8 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.495 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.6 t -129.41 148.23 51.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.845 0.355 . . . . 0.0 110.871 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -64.34 -39.08 93.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 45.2 p -66.43 -31.23 71.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.865 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.68 -53.04 24.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.893 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.488 HD11 ' OD1' ' A' ' 13' ' ' ASP . 3.9 mp -60.19 -50.75 72.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.857 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.906 0.384 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -145.62 149.26 34.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.899 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.584 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -63.73 -178.88 0.33 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.855 -179.951 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.2 mp -131.46 114.58 26.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.116 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -106.57 168.37 9.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.733 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 76.6 p -137.28 148.96 46.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.067 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.417 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 28.9 t -103.55 -167.94 1.44 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.833 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -84.79 -47.75 10.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.803 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -70.51 -28.08 64.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.976 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -56.98 -30.87 64.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.99 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -75.44 -46.81 30.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.926 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.1 mtpp -66.86 -21.91 66.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.173 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.22 -28.67 23.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.817 0.341 . . . . 0.0 111.099 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.557 ' O ' HG12 ' A' ' 18' ' ' VAL . 0.2 OUTLIER -79.28 -34.9 42.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.037 -179.883 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -56.81 -24.53 51.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.228 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.1 mm -80.36 -45.88 21.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.413 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.487 HD21 HD11 ' A' ' 65' ' ' LEU . 3.8 mp -72.65 -44.47 61.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.125 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.557 HG12 ' O ' ' A' ' 14' ' ' LEU . 13.3 p -56.4 -30.04 29.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.224 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.15 -40.19 22.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.997 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -70.59 -62.61 1.32 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.946 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -178.86 75.35 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.51 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.507 ' CE1' HD21 ' A' ' 26' ' ' LEU . 86.0 t80 -153.03 137.51 16.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.805 0.336 . . . . 0.0 110.869 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.24 119.49 39.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.79 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.596 HD23 ' H ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -55.46 -23.67 26.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.182 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.5 tttm -59.2 -50.24 74.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.027 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.507 HD21 ' CE1' ' A' ' 22' ' ' PHE . 2.0 pp -57.86 -28.54 64.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.096 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.527 ' HA ' HG12 ' A' ' 30' ' ' VAL . 4.5 tt -64.88 -26.68 68.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.998 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.683 ' O ' HG12 ' A' ' 31' ' ' VAL . 2.4 m-85 -80.38 -28.09 38.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.172 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -87.53 -29.35 21.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.195 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.527 HG12 ' HA ' ' A' ' 27' ' ' LEU . 15.0 p -75.31 -25.73 18.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.328 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.683 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.5 p -47.23 -32.86 2.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.496 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.36 -26.44 74.56 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.454 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -88.5 -23.78 23.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.759 0.314 . . . . 0.0 111.139 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 34.1 mt -69.34 -38.12 78.0 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.922 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.64 -12.16 59.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.623 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.1 p -107.68 -44.55 4.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.839 0.352 . . . . 0.0 110.99 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.657 ' HB3' HD11 ' A' ' 40' ' ' LEU . 3.0 mt-10 60.8 60.78 1.81 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.697 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.402 ' N ' ' CD ' ' A' ' 39' ' ' PRO . 1.1 mt-30 -91.64 -52.05 0.29 Allowed Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.519 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.402 ' CD ' ' N ' ' A' ' 38' ' ' GLN . 65.4 Cg_endo -80.29 -90.64 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 122.348 2.032 . . . . 0.0 112.988 -179.335 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.657 HD11 ' HB3' ' A' ' 37' ' ' GLU . 0.9 OUTLIER 62.41 -167.54 0.2 Allowed 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.761 0.315 . . . . 0.0 110.716 -179.609 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -112.38 137.41 21.57 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.997 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -73.58 -29.11 11.22 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.526 2.151 . . . . 0.0 112.37 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.71 -29.77 45.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.025 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -97.39 -53.3 3.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.995 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.52 149.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.833 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -97.28 147.31 24.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.86 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -172.82 159.71 3.72 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.953 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -56.34 177.19 0.16 Allowed 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.646 2.231 . . . . 0.0 112.377 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.478 HD13 ' HB3' ' A' ' 56' ' ' PHE . 11.1 mp -99.24 -54.96 2.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.838 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.2 mtmm -139.96 -176.71 4.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.854 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -91.66 -170.29 41.88 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.486 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 87.86 -71.89 2.53 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.461 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.602 HD12 ' HB2' ' A' ' 55' ' ' ASP . 0.2 OUTLIER -100.94 -37.63 8.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.794 0.33 . . . . 0.0 110.905 -179.853 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.57 28.07 13.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.02 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.602 ' HB2' HD12 ' A' ' 53' ' ' LEU . 0.7 OUTLIER -86.7 -45.93 10.51 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.719 179.885 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.478 ' HB3' HD13 ' A' ' 49' ' ' LEU . 45.7 m-85 -60.27 147.82 38.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.752 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.9 mtt85 -159.28 125.14 4.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.916 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -112.6 108.15 17.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.889 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.5 p -105.36 172.45 6.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.985 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -124.52 83.2 2.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.84 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.76 HD23 HD12 ' A' ' 67' ' ' LEU . 2.2 pp -55.73 -40.78 72.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.032 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.655 ' CG ' HD12 ' A' ' 61' ' ' LEU . 9.1 mmtm -117.54 155.87 49.91 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -48.23 -25.85 7.47 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.733 2.289 . . . . 0.0 112.627 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.679 ' O ' HD12 ' A' ' 65' ' ' LEU . 0.8 OUTLIER -141.04 75.36 1.5 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.816 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.679 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.2 OUTLIER -174.54 119.6 0.23 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.079 -179.85 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.795 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.1 OUTLIER -89.89 151.87 21.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.357 179.708 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.86 HD21 HD23 ' A' ' 80' ' ' LEU . 2.1 tt -145.3 97.58 3.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.919 0.39 . . . . 0.0 111.394 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.546 HG23 ' HB3' ' A' ' 82' ' ' ARG . 37.7 t -92.47 122.0 43.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.785 178.599 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.649 ' HD2' HD22 ' A' ' 67' ' ' LEU . 5.8 p90 -140.38 162.92 34.15 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.996 0.427 . . . . 0.0 111.412 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -144.26 108.08 4.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.575 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.574 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -84.88 133.65 28.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.927 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.35 100.67 10.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.716 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -58.68 -21.77 55.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.343 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -55.0 -29.89 58.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.79 0.329 . . . . 0.0 111.161 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -144.37 16.12 1.67 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.392 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 46.94 72.1 0.27 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.865 0.364 . . . . 0.0 111.251 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.584 HG23 ' HB ' ' A' ' 3' ' ' THR . 99.0 m -134.83 142.51 46.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.946 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.507 HD13 HG23 ' A' ' 31' ' ' VAL . 1.4 tt -99.64 93.11 5.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.726 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 3.6 t80 -92.2 107.62 19.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.877 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.86 HD23 HD21 ' A' ' 67' ' ' LEU . 2.1 mt -67.13 -179.85 1.04 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.563 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.413 ' N ' ' O ' ' A' ' 68' ' ' VAL . 43.9 t -154.25 -56.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.144 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.546 ' HB3' HG23 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -118.81 163.77 16.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.112 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -177.39 101.08 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.849 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.795 ' O ' HD12 ' A' ' 66' ' ' LEU . . . -178.21 169.43 41.17 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.523 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.3 p -95.48 148.81 22.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.8 0.333 . . . . 0.0 110.841 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -68.63 -30.99 69.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.881 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.1 t -70.07 -39.65 75.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.95 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -76.73 -59.04 2.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.882 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.475 HD11 ' HA3' ' A' ' 84' ' ' GLY . 4.4 mp -59.8 -58.25 9.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.911 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.249 -0.882 . . . . 0.0 110.875 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.805 0.336 . . . . 0.0 111.14 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.558 HD13 ' CB ' ' A' ' 78' ' ' LEU . 0.8 OUTLIER -123.07 148.38 45.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.908 -179.98 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.678 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -74.99 -171.14 1.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.013 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.441 ' H ' HG22 ' A' ' 3' ' ' THR . 4.6 mp -137.06 135.89 47.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.042 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -133.58 162.71 31.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.83 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.428 HG22 HD12 ' A' ' 80' ' ' LEU . 41.0 p -138.09 147.82 44.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.988 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -105.44 171.85 7.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.997 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -43.91 87.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.974 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -65.05 -42.65 94.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.885 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.701 ' CE2' HD13 ' A' ' 80' ' ' LEU . 13.3 t80 -59.22 -37.49 77.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.848 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -58.57 -30.49 67.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.825 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.8 mttp -82.11 -23.83 35.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.997 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.496 ' OD2' HD11 ' A' ' 89' ' ' LEU . 1.0 OUTLIER -79.22 -23.81 43.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.159 -179.895 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.59 HD13 ' CE1' ' A' ' 10' ' ' PHE . 2.1 tp -89.96 -39.38 13.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.247 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.3 -30.43 62.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.125 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.9 mm -82.19 -29.26 9.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.128 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.402 HD11 ' HA2' ' A' ' 84' ' ' GLY . 14.1 mt -79.37 -36.94 38.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.015 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.3 p -65.26 -33.99 67.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.058 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -74.13 -31.3 62.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.963 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -87.67 -56.18 3.46 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.904 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -176.83 78.45 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.545 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -158.25 166.77 31.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.795 0.331 . . . . 0.0 110.819 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -130.99 170.95 13.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.928 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.66 -52.37 3.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.916 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.95 -28.91 68.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.974 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.661 ' O ' HD13 ' A' ' 26' ' ' LEU . 3.4 tm? -58.46 -32.52 68.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.893 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.448 ' HA ' HG12 ' A' ' 30' ' ' VAL . 10.0 tt -77.49 -35.45 53.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.101 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.592 ' O ' HG22 ' A' ' 31' ' ' VAL . 6.4 m-85 -76.52 -23.43 53.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.969 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -88.73 -37.45 15.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.879 0.371 . . . . 0.0 111.002 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.448 HG12 ' HA ' ' A' ' 27' ' ' LEU . 12.1 p -66.08 -15.39 18.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.469 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.592 HG22 ' O ' ' A' ' 28' ' ' TYR . 22.5 m -49.25 -39.29 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.13 0 CA-C-O 120.73 0.3 . . . . 0.0 111.325 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.57 -27.3 63.48 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.485 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -89.81 -31.52 17.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.881 0.372 . . . . 0.0 110.91 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' A' ' 31' ' ' VAL . 65.3 mt -62.3 -46.75 87.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.848 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.88 -33.57 74.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.116 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 76.2 p -81.75 -42.27 20.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.987 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.834 ' HB3' HD11 ' A' ' 40' ' ' LEU . 14.2 mt-10 61.62 45.41 8.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.003 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.443 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 2.4 mt-30 -80.83 -52.3 0.89 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.17 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.443 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 50.4 Cg_endo -73.96 -85.5 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.13 1.887 . . . . 0.0 112.659 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.834 HD11 ' HB3' ' A' ' 37' ' ' GLU . 3.8 mt 59.88 22.87 11.88 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.762 0.315 . . . . 0.0 111.233 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 61.71 119.28 0.02 OUTLIER Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.071 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -75.07 59.49 5.25 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.449 2.099 . . . . 0.0 112.428 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.458 ' HG3' ' CE2' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -153.13 -45.22 0.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.93 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.458 ' CE2' ' HG3' ' A' ' 43' ' ' LYS . 14.9 m-85 -97.78 -49.96 4.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.828 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 63.61 126.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.901 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.583 ' HB2' HD13 ' A' ' 40' ' ' LEU . 17.5 t0 -57.97 132.17 52.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.92 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 41.2 p-80 -139.21 148.59 57.74 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.89 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.74 160.94 45.14 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.485 2.123 . . . . 0.0 112.329 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.9 mt -100.92 -175.8 2.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.931 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.8 mtmt -166.56 106.92 0.66 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.885 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 154.37 49.79 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.578 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.57 -23.18 37.33 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.588 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.0 mt -108.56 87.56 2.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.812 0.339 . . . . 0.0 110.829 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -96.5 27.66 3.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.046 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -147.92 27.56 0.96 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.881 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -126.1 153.81 43.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.807 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 29.4 mtt85 -164.0 139.56 6.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.906 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.468 ' HG3' HG22 ' A' ' 68' ' ' VAL . 0.7 OUTLIER -124.78 137.52 54.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.861 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.9 p -140.85 171.62 13.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.894 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.43 ' NE2' HD23 ' A' ' 66' ' ' LEU . 12.1 m-70 -115.69 82.32 1.74 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.828 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.549 HD23 ' H ' ' A' ' 61' ' ' LEU . 1.5 pt? -59.77 -30.41 68.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.032 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.441 ' HB3' HD13 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -136.1 149.99 69.85 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.903 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.605 ' O ' HD12 ' A' ' 65' ' ' LEU . 53.1 Cg_exo -52.31 129.17 30.33 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.583 2.189 . . . . 0.0 112.318 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 62.42 29.96 17.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.931 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.605 HD12 ' O ' ' A' ' 63' ' ' PRO . 2.6 mp -139.72 118.32 12.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.925 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.646 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -89.91 173.07 8.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.535 179.815 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.476 HD13 HD12 ' A' ' 83' ' ' LEU . 48.0 tp -164.47 99.34 0.81 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.985 0.421 . . . . 0.0 111.474 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.468 HG22 ' HG3' ' A' ' 58' ' ' GLU . 40.0 t -96.76 124.14 49.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.896 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 7.5 p90 -138.48 155.99 47.94 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.034 0.445 . . . . 0.0 111.409 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -130.58 116.07 17.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.455 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.526 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.4 mp -84.85 128.02 39.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.934 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.409 ' HB2' ' CG ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -102.98 101.65 11.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.672 179.818 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.2 mtmt -58.55 -23.15 57.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.255 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.409 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 1.0 OUTLIER -52.9 -32.44 45.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.818 0.342 . . . . 0.0 111.01 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -145.2 16.48 1.53 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.307 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 45.97 71.76 0.27 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.805 0.336 . . . . 0.0 111.448 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.678 HG23 ' HB ' ' A' ' 3' ' ' THR . 98.5 m -131.4 144.73 51.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.145 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.558 ' CB ' HD13 ' A' ' 2' ' ' LEU . 50.8 tp -101.27 89.66 3.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.41 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -89.98 120.79 31.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.804 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.701 HD13 ' CE2' ' A' ' 10' ' ' PHE . 2.2 mt -69.98 179.76 2.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.738 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.423 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 62.1 t -150.28 -66.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.094 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 -127.2 163.07 24.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.993 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.5 HD23 ' N ' ' A' ' 84' ' ' GLY . 5.2 tt -168.86 152.54 5.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.044 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.646 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 121.82 -168.21 14.55 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.47 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 16.0 t -95.51 171.33 8.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.785 0.326 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -80.56 -30.65 37.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.876 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 91.0 p -85.09 -42.65 14.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.016 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -61.55 -38.73 88.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.84 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.496 HD11 ' OD2' ' A' ' 13' ' ' ASP . 3.7 mm? -72.91 -41.03 65.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.88 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.307 -0.854 . . . . 0.0 110.881 -179.985 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.881 0.372 . . . . 0.0 111.119 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -143.51 149.66 37.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.929 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.578 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -60.42 -175.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.865 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -131.1 121.18 48.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.115 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -118.64 167.9 11.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.75 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.471 HG22 ' CE2' ' A' ' 10' ' ' PHE . 59.7 p -142.1 151.1 42.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.963 0.411 . . . . 0.0 110.97 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.407 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 0.3 OUTLIER -112.74 -167.03 1.13 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.98 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.77 -49.32 14.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.856 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.9 mttp -61.22 -31.27 71.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.967 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.616 ' HZ ' HD21 ' A' ' 27' ' ' LEU . 16.2 t80 -71.02 -47.07 60.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.939 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.32 -45.24 94.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.931 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.2 pttt -72.61 -16.04 61.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.375 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -84.43 -29.19 26.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.742 0.306 . . . . 0.0 111.108 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.595 HD23 HD22 ' A' ' 83' ' ' LEU . 9.6 mt -80.24 -36.47 34.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.071 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.8 pttt -58.67 -25.69 63.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.137 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.1 mm -85.13 -29.51 6.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.277 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.753 HD11 ' HA2' ' A' ' 84' ' ' GLY . 7.1 mt -82.89 -37.13 24.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.05 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.4 p -58.21 -30.4 39.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.051 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -30.75 34.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.916 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -98.76 31.04 3.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.86 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.01 94.3 0.75 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.571 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.736 ' CE1' HD11 ' A' ' 26' ' ' LEU . 16.1 t80 -175.13 100.61 0.08 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.737 0.303 . . . . 0.0 110.868 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.22 -177.51 0.53 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.905 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 40.3 mt -110.78 -31.32 7.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.963 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.26 -27.85 66.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.06 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.736 HD11 ' CE1' ' A' ' 22' ' ' PHE . 4.2 pp -57.17 -43.74 82.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.038 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.715 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -59.08 -48.25 82.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.974 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.639 ' O ' HG22 ' A' ' 31' ' ' VAL . 14.6 m-85 -62.23 -20.12 63.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.081 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -88.32 -29.96 19.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.999 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 26' ' ' LEU . 34.0 t -81.97 -26.36 9.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.28 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.676 HG13 ' O ' ' A' ' 27' ' ' LEU . 28.1 m -54.26 -31.65 22.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.285 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.24 -32.17 83.22 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.419 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -90.01 -28.4 19.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.673 0.273 . . . . 0.0 110.85 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 72.1 mt -62.23 -39.73 93.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.898 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.37 -41.13 85.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.103 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.3 p -77.85 -36.61 49.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.893 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.82 ' HA ' HD11 ' A' ' 40' ' ' LEU . 51.2 mt-10 61.25 43.71 10.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.053 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.401 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -92.83 -52.67 0.26 Allowed Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.211 -179.898 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.401 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 72.6 Cg_endo -84.12 -91.57 0.0 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.548 2.165 . . . . 0.0 112.783 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.82 HD11 ' HA ' ' A' ' 37' ' ' GLU . 1.3 mt 57.87 36.27 26.17 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.83 0.348 . . . . 0.0 110.876 -179.731 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 64.0 132.97 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.026 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -77.87 -1.16 11.34 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.571 2.181 . . . . 0.0 112.825 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.441 ' HG2' ' CD2' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -109.51 16.79 22.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.35 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.441 ' CD2' ' HG2' ' A' ' 43' ' ' LYS . 43.6 m-85 -146.49 -65.9 0.29 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.85 0.357 . . . . 0.0 110.871 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.1 mtpp 62.6 121.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.912 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -57.96 143.77 41.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.991 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.448 ' CG ' ' HD2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -154.61 156.33 31.44 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.797 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.448 ' HD2' ' CG ' ' A' ' 47' ' ' HIS . 43.1 Cg_endo -67.75 166.5 24.07 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.577 2.184 . . . . 0.0 112.332 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.03 -53.41 4.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.816 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -148.35 -177.48 5.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.008 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -110.15 46.09 1.22 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.524 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.17 12.67 6.39 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.751 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.681 HD12 ' H ' ' A' ' 55' ' ' ASP . 0.3 OUTLIER 179.35 -42.34 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.943 0.402 . . . . 0.0 110.863 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? 58.79 29.48 18.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.974 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.681 ' H ' HD12 ' A' ' 53' ' ' LEU . 74.2 m-20 -92.73 -37.35 12.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.802 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -88.42 153.65 21.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.982 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -164.04 147.08 9.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.712 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.529 ' HG3' HG22 ' A' ' 68' ' ' VAL . 4.1 tt0 -131.45 134.2 45.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.993 0.425 . . . . 0.0 111.151 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 25.0 p -125.46 -175.25 3.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.645 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -135.85 81.7 1.9 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.21 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.557 HD23 ' H ' ' A' ' 61' ' ' LEU . 1.3 pt? -59.93 -33.35 71.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.797 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.617 ' CB ' HD12 ' A' ' 65' ' ' LEU . 0.5 OUTLIER -113.6 141.57 26.21 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.341 179.74 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.401 ' HD2' ' HG3' ' A' ' 62' ' ' LYS . 9.4 Cg_endo -52.38 -20.46 11.62 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.651 2.234 . . . . 0.0 112.784 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.603 ' O ' HD23 ' A' ' 65' ' ' LEU . 0.6 OUTLIER -130.25 36.75 3.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.193 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.617 HD12 ' CB ' ' A' ' 62' ' ' LYS . 56.1 mt -151.82 164.86 36.15 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.944 0.402 . . . . 0.0 111.201 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.676 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -126.28 179.81 5.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.125 179.516 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 1.075 HD21 HD12 ' A' ' 80' ' ' LEU . 9.2 tt -170.03 102.92 0.3 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.822 0.344 . . . . 0.0 111.301 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.529 HG22 ' HG3' ' A' ' 58' ' ' GLU . 21.8 t -89.78 138.19 19.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.312 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.6 ' HA ' HG23 ' A' ' 81' ' ' VAL . 14.8 p90 -147.04 177.15 9.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.074 0.464 . . . . 0.0 111.344 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -148.0 123.04 10.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.474 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.525 ' N ' HD13 ' A' ' 71' ' ' ILE . 3.0 mm -84.69 138.41 19.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.342 -179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.412 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -122.77 87.63 2.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.657 179.8 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -22.11 21.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.177 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -46.73 -33.53 4.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.2 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -147.2 20.04 1.23 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.318 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 29.7 m120 48.21 69.33 0.56 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.872 0.368 . . . . 0.0 111.232 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.578 HG23 ' HB ' ' A' ' 3' ' ' THR . 52.2 m -135.1 137.68 43.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.966 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 35.9 tp -94.53 93.22 7.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.591 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.407 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.8 t80 -89.89 111.78 22.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.834 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 1.075 HD12 HD21 ' A' ' 67' ' ' LEU . 3.5 mm? -71.96 171.53 11.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.88 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.6 HG23 ' HA ' ' A' ' 69' ' ' TYR . 66.0 t -137.61 -72.72 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.162 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.0 mmm-85 -116.19 170.56 8.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.922 0.391 . . . . 0.0 111.047 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.872 HD12 HD12 ' A' ' 67' ' ' LEU . 9.4 tt -177.62 135.16 0.18 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.771 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.753 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 146.38 -168.68 27.78 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.558 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -96.47 144.24 26.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.816 0.341 . . . . 0.0 110.812 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -35.41 73.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.948 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 31.9 m -77.01 -47.1 21.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.96 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.46 -51.04 71.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.955 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.36 -31.08 71.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.863 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.846 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.9 mtp . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.799 0.333 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.67 HD22 HD12 ' A' ' 78' ' ' LEU . 0.5 OUTLIER -107.25 -179.07 3.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.867 179.916 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.448 HG22 ' H ' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -120.4 -171.89 2.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.89 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.448 ' H ' HG22 ' A' ' 3' ' ' THR . 4.3 mp -130.76 126.72 60.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.165 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -124.73 166.49 16.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.846 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 71.3 p -142.0 159.68 41.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.962 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -125.49 172.49 9.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.98 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -44.71 96.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.965 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.6 mttm -62.93 -31.25 72.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.769 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.44 ' CZ ' HD13 ' A' ' 14' ' ' LEU . 76.4 t80 -67.94 -34.88 77.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.839 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -69.77 -30.12 67.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.041 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.85 -21.07 55.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.259 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.744 ' OD1' HD21 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -87.44 -46.36 9.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.807 0.337 . . . . 0.0 111.036 -179.854 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.44 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 1.4 tp -63.43 -37.62 87.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.079 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.3 ptpt -57.44 -22.95 46.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.269 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 26.9 mm -85.88 -36.65 10.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.312 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.835 HD11 ' HA2' ' A' ' 84' ' ' GLY . 63.8 mt -78.58 -35.54 45.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.152 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.0 p -58.16 -33.28 46.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.144 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt -74.87 -30.47 61.33 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.921 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -102.38 30.02 4.84 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.856 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.74 92.53 1.01 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.548 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -176.76 94.96 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.796 0.331 . . . . 0.0 110.861 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.12 -179.06 0.7 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.887 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.2 mp -108.08 -31.74 7.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.851 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.42 -26.03 63.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.042 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.644 ' O ' HG23 ' A' ' 30' ' ' VAL . 3.9 pp -56.6 -38.3 71.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.132 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.662 HD21 HD11 ' A' ' 80' ' ' LEU . 4.4 tt -64.1 -37.35 87.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.918 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.656 ' O ' HG12 ' A' ' 31' ' ' VAL . 0.2 OUTLIER -59.63 -27.0 65.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.031 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.68 -31.67 20.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.885 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 26' ' ' LEU . 24.6 t -67.07 -21.76 28.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.342 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.656 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.2 p -49.98 -29.35 5.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.286 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -71.1 -38.54 63.59 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.46 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -79.81 -26.15 40.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.804 0.335 . . . . 0.0 110.911 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.592 ' HG ' HG12 ' A' ' 30' ' ' VAL . 77.6 mt -73.49 -29.06 62.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.946 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.33 -29.72 42.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.251 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.0 p -96.38 -38.88 9.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.048 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.936 ' HA ' HD21 ' A' ' 40' ' ' LEU . 21.4 mt-10 60.89 72.71 0.51 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.792 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.402 ' CB ' ' HD3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -100.08 -54.31 0.17 Allowed Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.634 -179.574 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.402 ' HD3' ' CB ' ' A' ' 38' ' ' GLN . 49.5 Cg_endo -83.69 -79.26 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.305 2.004 . . . . 0.0 113.111 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.936 HD21 ' HA ' ' A' ' 37' ' ' GLU . 1.2 mm? 46.7 40.73 9.11 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.846 0.355 . . . . 0.0 111.444 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.637 ' HB1' ' HD3' ' A' ' 43' ' ' LYS . . . 63.2 127.31 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.254 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 41' ' ' ALA . 25.6 Cg_exo -62.43 -25.63 76.19 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.494 2.129 . . . . 0.0 112.418 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.637 ' HD3' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -76.1 -30.94 58.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.325 -179.671 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -108.15 -62.6 1.43 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.054 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.9 mttt 63.72 31.35 14.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.804 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.7 t70 59.89 161.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.944 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -171.26 161.26 5.28 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.766 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.52 160.92 47.94 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.551 2.167 . . . . 0.0 112.322 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.92 -48.51 3.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.812 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? 60.7 -174.22 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.941 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.67 48.61 5.78 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.477 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.71 28.38 55.01 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.509 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -176.09 92.29 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.866 0.365 . . . . 0.0 110.878 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -86.64 -27.18 23.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.993 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -63.79 -42.29 97.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.888 0.375 . . . . 0.0 110.891 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.407 ' CG ' ' HB3' ' A' ' 70' ' ' GLN . 14.2 m-85 -60.76 156.27 17.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.83 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.565 ' O ' HG13 ' A' ' 68' ' ' VAL . 9.2 mtm-85 -165.78 175.58 8.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.859 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.582 ' HG3' HG22 ' A' ' 68' ' ' VAL . 14.9 tt0 -159.65 118.78 2.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.918 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.2 p -121.71 -176.88 3.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.852 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.524 ' NE2' HD23 ' A' ' 66' ' ' LEU . 7.3 m-70 -133.84 86.21 2.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.899 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.557 HD23 HD12 ' A' ' 67' ' ' LEU . 4.0 pp -59.11 -33.42 70.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.862 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.462 ' HE3' HD13 ' A' ' 65' ' ' LEU . 6.6 mtmt -111.4 167.31 9.25 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.77 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.29 -12.85 37.32 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.501 2.134 . . . . 0.0 112.482 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -154.7 54.42 0.67 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.727 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.462 HD13 ' HE3' ' A' ' 62' ' ' LYS . 0.2 OUTLIER -151.04 125.69 9.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.908 -179.824 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.77 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -91.87 161.53 14.8 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.612 179.709 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.557 HD12 HD23 ' A' ' 61' ' ' LEU . 5.7 tt -160.5 94.1 1.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.911 0.386 . . . . 0.0 111.112 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.582 HG22 ' HG3' ' A' ' 58' ' ' GLU . 34.7 t -89.96 136.33 24.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.341 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -154.39 154.03 32.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.852 0.358 . . . . 0.0 111.272 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.407 ' HB3' ' CG ' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -133.79 123.01 24.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.783 179.917 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.541 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -88.42 126.81 41.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.784 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.401 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -96.59 99.7 11.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.681 179.702 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.69 -23.05 26.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.204 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -50.97 -34.63 29.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.909 0.385 . . . . 0.0 111.047 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -143.89 16.82 1.77 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.202 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 m120 47.62 68.74 0.61 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.757 0.313 . . . . 0.0 111.343 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.401 ' HB ' ' CG ' ' A' ' 72' ' ' LYS . 97.9 m -128.32 138.68 52.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.052 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.67 HD12 HD22 ' A' ' 2' ' ' LEU . 1.2 tt -95.74 92.06 6.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.721 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.413 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 3.9 t80 -91.48 118.03 30.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.882 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.662 HD11 HD21 ' A' ' 27' ' ' LEU . 4.8 mt -76.14 179.38 5.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.69 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.406 ' N ' ' O ' ' A' ' 68' ' ' VAL . 90.9 t -150.36 -73.89 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.113 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.504 ' HB2' HG23 ' A' ' 68' ' ' VAL . 9.4 mtp85 -98.03 167.86 10.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.956 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.567 HD12 HD12 ' A' ' 17' ' ' LEU . 0.3 OUTLIER -178.3 90.14 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.876 179.974 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.835 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 176.49 175.74 44.08 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.402 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.9 t -98.01 151.58 20.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.901 0.381 . . . . 0.0 110.842 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -68.04 -47.58 68.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.922 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 29.7 p -60.54 -31.89 70.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.858 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.86 -60.52 2.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.872 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.744 HD21 ' OD1' ' A' ' 13' ' ' ASP . 3.8 mp -60.22 -32.97 71.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.887 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.219 -0.895 . . . . 0.0 110.854 -179.96 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 ttt . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.832 0.348 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.536 HD23 ' N ' ' A' ' 2' ' ' LEU . 0.2 OUTLIER -107.73 133.64 51.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.891 179.972 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -178.52 0.05 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.964 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.407 HD12 ' N ' ' A' ' 4' ' ' ILE . 4.3 mp -127.81 120.93 55.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.132 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -112.56 165.5 12.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.735 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 71.6 p -134.47 149.65 50.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.056 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.416 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 1.4 t -105.43 -172.24 2.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.936 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -75.96 -54.72 6.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.821 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -64.46 -33.17 75.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.799 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.826 ' CZ ' HD13 ' A' ' 80' ' ' LEU . 89.6 t80 -61.93 -30.09 70.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.906 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -68.99 -53.29 21.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.038 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.5 ptmm? -70.84 -10.37 59.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.48 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -85.82 -27.97 24.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.713 0.292 . . . . 0.0 110.946 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 14' ' ' LEU . 3.1 tp -83.44 -34.79 25.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.058 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.9 pttt -59.02 -29.24 67.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.169 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.2 mm -76.08 -39.46 36.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.327 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.674 HD11 ' HA2' ' A' ' 84' ' ' GLY . 10.7 mt -70.76 -44.22 67.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.014 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.1 p -59.76 -28.42 40.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.066 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -78.44 -30.51 47.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.887 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -87.27 -39.8 15.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.966 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 159.56 76.14 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.601 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -147.05 165.84 28.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.808 0.337 . . . . 0.0 110.862 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -125.3 165.98 17.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.963 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.9 mp -90.28 -54.25 4.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.8 mmtt -58.24 -22.96 54.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.1 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.574 ' O ' HG23 ' A' ' 30' ' ' VAL . 3.0 tm? -54.21 -52.74 60.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.033 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.6 -30.65 70.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.96 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -73.24 -26.45 61.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.085 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.23 -33.79 24.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.005 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 26' ' ' LEU . 41.0 t -71.59 -16.82 19.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.447 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.2 t -49.53 -28.33 3.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 120.828 0.347 . . . . 0.0 111.26 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -73.5 -26.72 69.2 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.42 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -90.11 -29.3 18.41 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.758 0.313 . . . . 0.0 110.857 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.3 mt -66.04 -37.92 87.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.904 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.47 -31.61 60.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.111 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 43.4 p -82.51 -44.03 16.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.853 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.639 ' HA ' HD11 ' A' ' 40' ' ' LEU . 16.8 mt-10 61.29 51.9 4.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.945 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -93.55 -53.02 0.25 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.139 -179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -85.12 -88.97 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.513 2.142 . . . . 0.0 112.726 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.639 HD11 ' HA ' ' A' ' 37' ' ' GLU . 0.8 OUTLIER 56.17 28.79 13.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.801 0.334 . . . . 0.0 111.127 180.0 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 61.66 116.44 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.053 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -66.85 -26.27 44.8 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.424 2.083 . . . . 0.0 112.324 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.71 -30.82 71.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.986 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -108.71 -59.51 1.87 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.956 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.4 mttm 63.99 134.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.944 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -66.73 155.15 38.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.954 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 10.9 p-80 -171.48 156.18 4.29 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.897 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.48 170.59 10.74 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.616 2.211 . . . . 0.0 112.19 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.5 mt -104.41 -48.06 3.93 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.023 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.61 140.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.874 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 112.77 43.18 0.89 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.415 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.78 -32.93 6.49 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.533 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.1 mt -113.03 62.26 0.64 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.911 0.386 . . . . 0.0 110.803 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -41.6 83.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.98 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -59.67 -31.39 69.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.944 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.553 ' HE2' HG11 ' A' ' 81' ' ' VAL . 2.5 m-85 -74.94 141.72 44.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.858 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.3 mtt180 -156.74 152.91 27.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.849 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -131.39 149.5 52.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.025 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.568 ' SG ' HD23 ' A' ' 67' ' ' LEU . 32.1 p -139.54 -173.25 3.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.778 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -138.86 85.04 2.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.948 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.491 HD23 HD22 ' A' ' 67' ' ' LEU . 2.1 pp -64.81 -41.08 96.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.816 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.432 ' HD3' HD22 ' A' ' 65' ' ' LEU . 8.0 mttt -102.65 166.61 11.65 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.833 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.85 -12.28 34.85 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.576 2.184 . . . . 0.0 112.425 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -154.33 52.05 0.66 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.888 0.375 . . . . 0.0 110.614 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.432 HD22 ' HD3' ' A' ' 62' ' ' LYS . 0.7 OUTLIER -152.6 127.78 9.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.955 -179.705 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.783 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -89.92 166.33 13.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.502 179.7 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.568 HD23 ' SG ' ' A' ' 59' ' ' CYS . 43.9 tp -159.46 98.57 1.41 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.967 0.413 . . . . 0.0 111.614 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.444 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 19.9 t -95.08 124.74 47.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.691 178.446 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.462 ' CD1' ' CD1' ' A' ' 71' ' ' ILE . 7.8 p90 -141.18 163.39 33.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.128 0.49 . . . . 0.0 111.534 -179.176 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -141.66 107.62 5.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.399 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.566 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -84.88 146.28 6.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.014 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.17 104.72 10.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.693 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -59.96 -21.02 60.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.176 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.1 tp-100 -52.46 -33.6 45.2 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.104 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -144.32 17.19 1.7 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.268 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 47.38 74.79 0.15 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.894 0.378 . . . . 0.0 111.234 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 82.3 m -134.46 148.72 50.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.996 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.479 ' HB2' HD12 ' A' ' 2' ' ' LEU . 1.2 tt -107.67 93.04 4.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.63 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.416 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.7 t80 -89.99 105.74 18.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.991 -179.746 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.826 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 3.8 mt -65.73 -179.38 0.67 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.521 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.553 HG11 ' HE2' ' A' ' 56' ' ' PHE . 59.9 t -154.81 -59.53 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.24 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.408 ' HB2' ' CG2' ' A' ' 68' ' ' VAL . 0.0 OUTLIER -113.25 165.95 11.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.85 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.497 ' CD2' HD13 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -177.84 99.16 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.963 -179.944 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.783 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 165.29 -161.39 34.8 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.39 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.2 p -123.03 155.51 36.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.751 0.31 . . . . 0.0 110.976 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -69.17 -31.53 70.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.97 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.1 t -74.78 -34.98 62.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.945 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.93 -57.2 4.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.898 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.2 mp -61.04 -70.8 0.16 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.971 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.818 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mmt . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.825 0.345 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.572 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -144.71 145.91 31.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.844 -179.992 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.665 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -80.26 -173.61 4.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.882 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.4 mp -139.9 112.98 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.99 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -112.41 162.45 15.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.749 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.622 HG22 HD12 ' A' ' 80' ' ' LEU . 74.4 p -141.95 143.3 33.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.074 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.27 175.28 9.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.968 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.5 mtmt -64.79 -45.74 85.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.836 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -61.14 -21.71 64.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.092 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CZ ' ' HB2' ' A' ' 83' ' ' LEU . 1.0 OUTLIER -65.31 -32.45 74.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.004 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.12 -44.43 79.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.935 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.23 -8.85 59.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.371 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.14 -27.27 19.72 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.669 0.271 . . . . 0.0 111.257 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.9 -41.71 11.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.462 -179.628 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.6 pttm -54.67 -24.31 21.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.345 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.2 mm -83.43 -32.16 8.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.108 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.526 HD13 HD21 ' A' ' 65' ' ' LEU . 91.2 mt -82.03 -38.05 25.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.051 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.0 p -59.27 -30.48 44.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.115 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.31 -45.89 24.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.819 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -71.66 -31.6 67.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.82 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 149.56 75.98 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.543 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.718 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 8.2 t80 -153.7 165.46 35.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.876 0.369 . . . . 0.0 110.907 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -145.51 164.5 31.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.821 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.6 mp -94.77 -29.04 14.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.948 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -33.35 69.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.919 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.718 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 4.4 pp -74.1 -30.66 62.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.021 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.468 ' HA ' HG12 ' A' ' 30' ' ' VAL . 7.3 tt -73.78 -25.99 60.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.137 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.607 ' O ' HG22 ' A' ' 31' ' ' VAL . 0.7 OUTLIER -81.01 -28.58 35.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.094 -179.936 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.73 -36.11 17.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.042 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.468 HG12 ' HA ' ' A' ' 27' ' ' LEU . 13.1 p -62.6 -21.12 26.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.392 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.607 HG22 ' O ' ' A' ' 28' ' ' TYR . 27.8 m -47.68 -32.56 2.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.834 0.349 . . . . 0.0 111.462 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.83 -26.52 74.29 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.474 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -89.88 -27.38 19.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.744 0.307 . . . . 0.0 110.967 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 69.2 mt -66.49 -43.93 84.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.015 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.03 -37.43 72.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.276 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 53.3 p -78.7 -41.44 31.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.021 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.817 ' HA ' HD21 ' A' ' 40' ' ' LEU . 9.2 mt-10 62.08 49.95 4.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.87 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.552 ' H ' ' HD2' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -98.76 -61.76 0.11 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.641 -179.827 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.552 ' HD2' ' H ' ' A' ' 38' ' ' GLN . 30.1 Cg_endo -63.66 -85.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.274 1.983 . . . . 0.0 112.958 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.817 HD21 ' HA ' ' A' ' 37' ' ' GLU . 1.1 mm? 47.61 -173.1 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.801 0.334 . . . . 0.0 111.376 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.404 ' HB1' ' HE2' ' A' ' 43' ' ' LYS . . . -105.25 145.64 31.16 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.12 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.408 ' HA ' ' HD2' ' A' ' 45' ' ' LYS . 73.5 Cg_endo -75.72 -28.92 7.62 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.618 2.212 . . . . 0.0 112.352 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.404 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 2.9 pttt -76.71 -27.28 55.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.044 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.501 ' CD2' ' CG ' ' A' ' 60' ' ' HIS . 19.8 m-85 -105.29 -54.6 2.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.926 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HD2' ' HA ' ' A' ' 42' ' ' PRO . 0.0 OUTLIER 62.92 147.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.803 -179.896 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -87.19 134.53 33.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.976 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.416 ' CG ' ' HD2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -173.22 162.44 3.48 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.857 179.928 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.416 ' HD2' ' CG ' ' A' ' 47' ' ' HIS . 44.0 Cg_endo -67.96 -177.88 1.47 Allowed 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.583 2.189 . . . . 0.0 112.264 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.8 mp -103.76 -69.29 0.81 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.995 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -178.61 159.42 1.13 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.883 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 111.71 -166.57 12.25 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.551 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -110.82 -20.05 7.44 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.643 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.727 HD12 ' H ' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -53.35 -47.02 69.75 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.837 0.351 . . . . 0.0 111.235 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 58.61 29.73 18.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.041 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.727 ' H ' HD12 ' A' ' 53' ' ' LEU . 4.5 m-20 -104.56 -31.46 9.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.804 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.422 ' CE2' HG21 ' A' ' 81' ' ' VAL . 7.8 m-85 -89.89 137.42 32.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.844 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.3 mtt180 -154.34 148.64 26.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.862 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.437 ' HG3' HG22 ' A' ' 68' ' ' VAL . 30.9 tt0 -118.2 150.04 40.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.04 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 30.4 p -148.47 151.41 35.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.857 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.501 ' CG ' ' CD2' ' A' ' 44' ' ' TYR . 17.2 m-70 -107.83 92.42 4.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.899 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.754 HD12 ' HB2' ' A' ' 62' ' ' LYS . 4.3 pp -68.04 -30.87 70.19 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.782 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.754 ' HB2' HD12 ' A' ' 61' ' ' LEU . 33.2 tptt -140.24 139.55 21.23 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.61 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_exo -43.44 132.96 7.07 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.565 2.177 . . . . 0.0 112.419 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 65.87 25.58 11.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.799 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.526 HD21 HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -145.81 120.0 9.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.712 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.478 HD11 ' HA ' ' A' ' 85' ' ' SER . 0.0 OUTLIER -101.43 -178.25 3.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.679 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.521 ' HG ' HD23 ' A' ' 83' ' ' LEU . 6.8 tt -167.92 103.55 0.48 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.071 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.437 HG22 ' HG3' ' A' ' 58' ' ' GLU . 24.8 t -94.88 138.98 19.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.543 179.593 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.754 ' HA ' HG23 ' A' ' 81' ' ' VAL . 6.1 p90 -147.85 161.95 40.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 0.0 111.31 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -128.52 120.24 26.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.438 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.518 ' N ' HD13 ' A' ' 71' ' ' ILE . 3.0 mm -84.71 141.51 14.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.38 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.427 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -127.45 87.5 2.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.695 179.806 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -56.39 -22.53 32.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.248 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -50.11 -32.82 16.83 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.891 0.377 . . . . 0.0 111.118 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -142.9 16.6 1.95 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.179 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 47.43 68.3 0.67 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.843 0.354 . . . . 0.0 111.22 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.665 HG23 ' HB ' ' A' ' 3' ' ' THR . 88.7 m -133.41 136.29 45.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.911 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.572 ' HB2' HD12 ' A' ' 2' ' ' LEU . 34.3 tp -95.06 92.37 6.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.727 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -90.08 115.74 27.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.966 -179.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.622 HD12 HG22 ' A' ' 6' ' ' THR . 30.6 mt -73.27 171.52 12.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.742 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.754 HG23 ' HA ' ' A' ' 69' ' ' TYR . 57.9 t -133.51 -70.22 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.291 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -118.45 175.78 5.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.117 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.521 HD23 ' HG ' ' A' ' 67' ' ' LEU . 0.4 OUTLIER -173.47 90.96 0.08 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.849 -179.983 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.62 127.92 1.49 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.749 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.478 ' HA ' HD11 ' A' ' 66' ' ' LEU . 0.6 OUTLIER -54.33 154.91 4.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.829 0.347 . . . . 0.0 111.127 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.84 -33.59 75.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.897 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.36 -32.35 60.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.875 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -67.18 -48.06 69.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.912 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.91 -39.23 93.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.823 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.288 -0.863 . . . . 0.0 110.868 -179.999 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.5 ttt . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.88 0.371 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.823 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -103.86 136.63 43.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.808 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.467 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -57.96 -176.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.015 -179.806 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.51 HG12 HG21 ' A' ' 31' ' ' VAL . 4.3 mp -136.36 115.26 15.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.994 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -108.64 159.68 16.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.813 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 39.9 p -139.19 150.05 45.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.926 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.4 ' HB2' ' CZ ' ' A' ' 79' ' ' PHE . 0.1 OUTLIER -118.19 -168.83 1.59 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.944 179.975 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -78.07 -46.08 21.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.898 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -61.47 -33.79 74.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.771 ' CZ ' HD11 ' A' ' 14' ' ' LEU . 13.2 t80 -69.88 -37.68 76.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -72.94 -29.52 63.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.978 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -76.22 -23.19 54.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.153 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.456 ' OD1' HD11 ' A' ' 89' ' ' LEU . 0.4 OUTLIER -84.37 -46.79 11.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.069 -179.817 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.771 HD11 ' CZ ' ' A' ' 10' ' ' PHE . 81.0 mt -59.79 -37.46 79.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.096 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt -56.95 -26.83 60.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.141 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.9 mm -82.45 -33.65 11.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.172 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.3 mt -79.99 -41.3 26.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.033 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.6 p -57.84 -29.55 35.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.157 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.2 tttt -81.21 -31.22 34.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.93 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -100.43 30.39 3.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.971 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.11 95.3 0.81 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.592 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.686 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 11.4 t80 -176.6 113.39 0.1 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.814 0.34 . . . . 0.0 110.831 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.499 ' HB2' HD23 ' A' ' 26' ' ' LEU . 5.0 m-20 -74.85 160.39 30.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.956 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.82 -28.2 14.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.993 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.9 mtmm -69.23 -29.6 67.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.957 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.686 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 4.4 pp -58.6 -30.97 67.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.953 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.64 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -75.99 -23.91 55.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.159 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -82.44 -30.55 29.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.785 0.326 . . . . 0.0 111.003 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -88.31 -33.46 18.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.031 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.546 HG22 ' HG ' ' A' ' 34' ' ' LEU . 10.8 p -62.74 -21.52 27.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.321 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.51 HG21 HG12 ' A' ' 4' ' ' ILE . 36.1 t -47.5 -38.33 5.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.293 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.422 ' O ' HG23 ' A' ' 36' ' ' THR . . . -64.27 -32.57 84.64 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.387 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -89.99 -23.19 21.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.748 0.309 . . . . 0.0 111.173 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.546 ' HG ' HG22 ' A' ' 30' ' ' VAL . 52.3 mt -69.77 -40.44 76.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.054 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.414 ' HB2' HD11 ' A' ' 2' ' ' LEU . . . -72.8 -36.6 67.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.276 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.422 HG23 ' O ' ' A' ' 32' ' ' GLY . 25.7 p -83.32 -42.5 17.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.93 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.448 ' HA ' HD11 ' A' ' 40' ' ' LEU . 13.3 mt-10 61.04 58.67 2.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.857 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.406 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 0.5 OUTLIER -88.71 -51.74 0.38 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.517 -179.65 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.406 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 63.1 Cg_endo -77.82 -91.29 0.0 OUTLIER 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 122.174 1.916 . . . . 0.0 112.696 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.57 HD21 ' HB2' ' A' ' 59' ' ' CYS . 3.1 mp 56.51 -178.85 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.801 0.334 . . . . 0.0 111.038 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -94.78 142.15 24.3 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.0 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -74.73 -24.47 13.39 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.553 2.169 . . . . 0.0 112.47 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.54 -29.23 26.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.093 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -95.36 -62.11 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.109 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 mmtt 62.33 149.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.847 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.422 ' HB2' ' CD2' ' A' ' 40' ' ' LEU . 40.8 t0 -93.72 142.5 27.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.997 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 9.9 p80 -154.85 142.29 13.85 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.76 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -73.57 -168.2 0.43 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.482 2.121 . . . . 0.0 112.405 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mt -132.79 -174.95 3.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.751 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -158.12 172.37 18.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.937 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 75.01 50.13 8.94 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.369 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 106.36 -22.0 31.8 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.486 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.1 mt -122.46 93.98 4.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.689 0.28 . . . . 0.0 110.856 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.5 mmtp -101.64 -41.99 6.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.953 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 -72.35 -30.15 64.46 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.947 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -62.3 139.49 58.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.857 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 56.1 mtm180 -154.65 135.45 13.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.847 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -110.39 119.18 38.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.849 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.57 ' HB2' HD21 ' A' ' 40' ' ' LEU . 24.7 p -127.0 144.61 50.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.781 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -108.06 83.17 1.75 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.028 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 pp -59.04 -32.41 69.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.671 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.651 ' HB2' HD12 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -113.62 170.06 5.77 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.679 179.815 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.425 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 55.1 Cg_endo -70.1 -8.38 23.47 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.384 2.056 . . . . 0.0 112.781 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -151.43 40.69 0.69 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.739 0.304 . . . . 0.0 111.137 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.651 HD12 ' HB2' ' A' ' 62' ' ' LYS . 27.4 mt -131.59 133.7 45.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.052 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.653 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -113.96 116.16 28.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.716 179.739 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.722 ' HG ' HD12 ' A' ' 83' ' ' LEU . 0.4 OUTLIER -113.97 94.62 4.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.998 0.428 . . . . 0.0 111.143 -179.832 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.541 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 26.2 t -96.84 69.87 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.841 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.618 ' HD2' HD22 ' A' ' 67' ' ' LEU . 3.1 p90 -89.51 177.14 6.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.098 0.475 . . . . 0.0 111.345 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -146.15 122.51 10.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.709 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.547 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -92.65 138.17 20.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.852 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.09 102.5 11.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.658 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.63 -20.5 56.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.263 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -52.88 -29.42 28.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.734 0.302 . . . . 0.0 111.081 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -149.23 19.13 0.96 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.277 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 34.8 m120 46.46 74.77 0.14 Allowed 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.731 0.3 . . . . 0.0 111.303 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.467 HG23 ' HB ' ' A' ' 3' ' ' THR . 53.9 m -133.81 147.45 51.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.165 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.823 ' HB2' HD12 ' A' ' 2' ' ' LEU . 0.9 OUTLIER -107.4 95.59 5.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.553 179.596 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CZ ' ' HB2' ' A' ' 7' ' ' SER . 5.4 t80 -89.9 111.65 22.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.866 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.516 HD12 HD21 ' A' ' 67' ' ' LEU . 3.1 mm? -68.23 168.96 11.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.607 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.541 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 98.3 t -152.02 -84.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.432 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 11.1 mtm-85 -96.23 160.44 14.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.865 0.364 . . . . 0.0 111.254 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.722 HD12 ' HG ' ' A' ' 67' ' ' LEU . 0.3 OUTLIER -179.64 114.22 0.05 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.612 179.816 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.653 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 145.55 -159.93 28.0 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.42 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.414 ' O ' HD12 ' A' ' 89' ' ' LEU . 0.3 OUTLIER -121.22 141.05 51.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.809 0.338 . . . . 0.0 110.828 179.854 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -58.95 -30.35 67.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.914 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.1 m -78.23 -32.68 49.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.922 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -70.0 -46.88 64.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.958 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.456 HD11 ' OD1' ' A' ' 13' ' ' ASP . 4.0 mp -60.09 -31.51 70.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.92 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.965 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 ptp . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.899 0.38 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.804 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -128.82 133.52 48.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.922 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.648 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -65.51 -175.57 0.27 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.841 -179.994 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.557 HG12 HG11 ' A' ' 31' ' ' VAL . 4.2 mp -133.37 116.19 24.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.108 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -110.19 168.18 9.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.81 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.431 HG22 ' CE2' ' A' ' 10' ' ' PHE . 77.6 p -138.41 147.93 43.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.894 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.404 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 2.6 t -105.71 -168.19 1.42 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.886 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -74.53 -58.18 3.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.966 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -58.88 -34.56 71.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.964 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.593 ' HZ ' HD21 ' A' ' 27' ' ' LEU . 10.7 t80 -60.29 -34.86 74.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.927 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.32 -35.02 63.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.862 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.7 mtpp -82.11 -20.96 37.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.087 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.566 ' CG ' HD21 ' A' ' 89' ' ' LEU . 2.0 m-20 -84.1 -28.44 27.52 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.139 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -83.8 -36.49 23.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.161 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 12.6 pttp -58.6 -29.98 66.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.055 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.4 mm -83.62 -33.24 9.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.118 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.564 HD11 ' CA ' ' A' ' 84' ' ' GLY . 18.1 mt -73.68 -43.14 60.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.912 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.2 p -60.24 -30.93 47.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.11 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -72.92 -33.74 66.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.804 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -84.97 -48.74 8.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.927 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 163.3 76.95 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.501 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.867 ' CE1' HD11 ' A' ' 26' ' ' LEU . 56.4 t80 -153.07 116.8 4.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.858 0.361 . . . . 0.0 110.908 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.47 156.13 24.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.866 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.3 mp -91.36 -29.93 16.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.913 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -58.81 -36.87 75.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.97 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.867 HD11 ' CE1' ' A' ' 22' ' ' PHE . 3.9 pp -66.35 -30.67 71.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.885 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.593 HD21 ' HZ ' ' A' ' 10' ' ' PHE . 9.1 tp -71.71 -29.07 64.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.983 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.515 ' O ' HG22 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -83.21 -25.22 31.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.956 179.936 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 mttt -88.04 -34.45 17.99 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.075 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.4 p -60.28 -19.63 18.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.331 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.557 HG11 HG12 ' A' ' 4' ' ' ILE . 29.4 m -48.7 -41.06 12.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.827 0.346 . . . . 0.0 111.362 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.414 ' N ' HG23 ' A' ' 31' ' ' VAL . . . -60.66 -27.5 66.42 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.371 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -89.29 -30.01 18.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 0.0 110.871 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.3 mt -63.38 -38.07 89.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.873 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.93 -51.97 14.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.079 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.5 p -66.35 -44.54 82.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.917 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.749 ' HA ' HD11 ' A' ' 40' ' ' LEU . 33.6 mt-10 60.42 51.92 5.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.891 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.4 ' N ' ' CD ' ' A' ' 39' ' ' PRO . 0.5 OUTLIER -91.31 -52.12 0.3 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.233 -179.841 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.4 ' CD ' ' N ' ' A' ' 38' ' ' GLN . 74.3 Cg_endo -84.18 -92.13 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.406 2.071 . . . . 0.0 112.684 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.749 HD11 ' HA ' ' A' ' 37' ' ' GLU . 0.6 OUTLIER 54.55 36.78 26.63 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-O 120.849 0.357 . . . . 0.0 111.143 -179.967 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.54 127.95 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.08 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -77.27 -3.4 13.65 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.482 2.121 . . . . 0.0 112.832 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -102.63 -32.38 9.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 0.0 111.023 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -95.25 -52.68 4.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.904 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.2 mmtt 62.69 148.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.794 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.538 ' CB ' HD13 ' A' ' 40' ' ' LEU . 59.5 t0 -91.51 139.56 30.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.949 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 11.8 p-80 -158.42 146.42 13.78 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.79 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -73.18 -175.55 2.02 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.532 2.155 . . . . 0.0 112.337 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.511 HD12 ' HB2' ' A' ' 56' ' ' PHE . 35.7 mt -98.46 -69.75 0.75 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.883 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HB2' HD11 ' A' ' 53' ' ' LEU . 1.1 mttm -140.84 95.08 2.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.818 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -63.34 122.4 26.87 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.53 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 112.3 27.92 3.74 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.634 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.667 HD12 ' CG ' ' A' ' 54' ' ' LYS . 1.4 pp -179.04 -38.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.851 0.358 . . . . 0.0 111.014 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.667 ' CG ' HD12 ' A' ' 53' ' ' LEU . 11.4 mmtt -132.96 129.7 38.59 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.926 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -94.74 20.29 8.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.029 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.511 ' HB2' HD12 ' A' ' 49' ' ' LEU . 9.9 m-85 -78.02 143.98 37.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.832 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -156.4 142.8 18.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.595 -179.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.413 ' CG ' HG22 ' A' ' 68' ' ' VAL . 24.1 tt0 -128.5 148.89 50.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.124 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 32.1 p -137.15 -172.46 3.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.631 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -143.73 85.84 1.85 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.981 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.701 ' CD2' HD12 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -61.01 -43.43 98.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.75 179.843 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.504 ' HD2' HD12 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -99.51 166.36 13.03 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.859 179.827 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.39 -3.53 14.02 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.749 2.299 . . . . 0.0 112.972 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -147.59 33.83 0.86 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.609 0.242 . . . . 0.0 111.08 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 mp -151.84 145.59 25.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.903 0.382 . . . . 0.0 111.098 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -110.53 -173.19 2.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.293 179.602 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.87 HD21 ' CD1' ' A' ' 80' ' ' LEU . 4.1 tt -169.99 103.58 0.31 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.876 0.37 . . . . 0.0 111.431 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.413 HG22 ' CG ' ' A' ' 58' ' ' GLU . 13.7 t -94.66 120.95 44.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.09 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.672 ' HD2' HD22 ' A' ' 67' ' ' LEU . 6.3 p90 -137.78 159.54 41.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.004 0.431 . . . . 0.0 111.433 -179.571 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -132.42 122.74 25.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.505 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.529 ' N ' HD13 ' A' ' 71' ' ' ILE . 3.0 mm -84.74 131.04 34.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.41 -179.568 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.431 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -111.82 85.02 2.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.665 179.757 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.0 mttt -56.19 -23.02 32.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.264 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -51.97 -30.38 24.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.845 0.355 . . . . 0.0 111.047 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -142.25 16.47 2.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.311 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 47.05 69.31 0.51 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.858 0.361 . . . . 0.0 111.311 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.648 HG23 ' HB ' ' A' ' 3' ' ' THR . 49.3 m -139.13 143.67 38.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.067 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.804 ' HB2' HD12 ' A' ' 2' ' ' LEU . 0.6 OUTLIER -97.29 96.45 8.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.668 179.722 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.408 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 3.7 t80 -94.39 114.19 26.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.945 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.87 ' CD1' HD21 ' A' ' 67' ' ' LEU . 3.0 mm? -69.62 169.86 11.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.797 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.574 HG23 ' HA ' ' A' ' 69' ' ' TYR . 35.1 t -136.41 -63.66 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.069 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.8 ttt85 -133.07 172.52 12.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.914 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.736 HD12 ' HG ' ' A' ' 67' ' ' LEU . 1.9 tt -176.84 146.53 0.55 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.949 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.564 ' CA ' HD11 ' A' ' 17' ' ' LEU . . . 99.94 129.52 6.64 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.488 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -52.68 138.93 27.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.84 0.352 . . . . 0.0 111.09 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -30.12 66.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.936 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.9 p -64.65 -32.96 74.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -73.73 -44.81 55.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.91 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.566 HD21 ' CG ' ' A' ' 13' ' ' ASP . 5.0 mp -64.58 -66.99 0.47 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.868 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.2 mtt . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.771 0.32 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.1 mt -102.77 151.66 22.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.898 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.691 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -69.39 -177.32 1.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.862 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.512 HG12 HG11 ' A' ' 31' ' ' VAL . 3.8 mp -133.8 116.91 24.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.196 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -110.49 159.81 17.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.712 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 34.2 p -130.93 149.85 52.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.115 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.9 t -106.13 -166.8 1.23 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.8 mtmm -82.85 -52.09 7.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.027 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.4 mmtp -70.24 -31.77 69.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.027 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.633 ' CE1' HD11 ' A' ' 14' ' ' LEU . 76.4 t80 -59.95 -53.66 55.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.884 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.29 -31.03 68.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.988 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -82.35 -20.03 38.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.179 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.515 ' O ' HD23 ' A' ' 17' ' ' LEU . 2.7 m-20 -85.37 -28.36 25.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.19 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.669 ' O ' HG23 ' A' ' 18' ' ' VAL . 3.9 mp -81.59 -37.65 27.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.162 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.1 ptpt -58.27 -29.77 66.07 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.089 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.1 mm -81.05 -43.81 20.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.069 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.574 ' CD1' HD21 ' A' ' 65' ' ' LEU . 2.1 mm? -56.62 -26.84 56.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.924 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.669 HG23 ' O ' ' A' ' 14' ' ' LEU . 20.6 t -57.41 -54.59 28.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.126 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.1 tptm -59.18 -28.67 66.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.08 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -97.84 33.57 2.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.973 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.79 88.35 0.38 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.486 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.456 ' CE1' HD11 ' A' ' 26' ' ' LEU . 7.4 t80 -176.56 166.84 2.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.74 0.305 . . . . 0.0 110.838 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -157.01 158.99 37.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.912 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -88.39 -29.68 20.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.003 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -63.58 -45.2 91.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.906 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.742 HD12 ' N ' ' A' ' 27' ' ' LEU . 4.3 pp -60.1 -31.63 70.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.921 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.742 ' N ' HD12 ' A' ' 26' ' ' LEU . 3.7 tt -76.26 -28.7 57.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.913 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.641 ' O ' HG22 ' A' ' 31' ' ' VAL . 0.2 OUTLIER -59.11 -29.49 67.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.907 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.61 -30.85 18.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.055 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.694 HG23 ' O ' ' A' ' 26' ' ' LEU . 34.6 t -64.38 -22.49 31.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.247 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 28' ' ' TYR . 29.1 m -50.35 -29.29 6.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.226 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -70.0 -33.74 70.24 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.397 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -86.32 -28.93 23.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.739 0.304 . . . . 0.0 110.881 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.547 ' HG ' HG12 ' A' ' 30' ' ' VAL . 90.0 mt -63.25 -38.31 90.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.831 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.24 -34.9 61.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.185 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 51.4 p -78.86 -41.35 30.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.837 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.409 ' HA ' HD21 ' A' ' 40' ' ' LEU . 26.8 mt-10 58.07 61.39 2.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.972 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.435 ' CB ' ' HD3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -102.48 -55.18 0.12 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.411 -179.79 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.435 ' HD3' ' CB ' ' A' ' 38' ' ' GLN . 41.7 Cg_endo -86.04 -76.36 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.379 2.053 . . . . 0.0 112.338 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.693 HD12 ' HB3' ' A' ' 59' ' ' CYS . 2.5 mm? 48.65 27.65 1.57 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.814 0.34 . . . . 0.0 111.433 179.523 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 62.11 121.01 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.116 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.95 -35.78 90.54 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.425 2.084 . . . . 0.0 112.388 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.73 -30.45 68.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.852 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -109.63 63.86 0.61 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.857 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.7 mttp -60.29 102.5 0.18 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.815 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -51.56 145.33 9.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.087 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -168.28 162.97 8.82 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.914 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.18 172.73 14.21 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.605 2.204 . . . . 0.0 112.353 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.91 -45.11 9.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.827 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt 68.69 151.74 0.09 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.952 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 111.35 -97.22 0.93 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.44 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -106.91 23.5 27.52 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.578 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.788 ' O ' HD12 ' A' ' 53' ' ' LEU . 1.0 OUTLIER 179.94 114.61 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.904 0.383 . . . . 0.0 110.8 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.4 -38.4 9.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.856 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.61 -18.23 61.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.182 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.501 ' HB2' HD13 ' A' ' 53' ' ' LEU . 4.3 m-85 -94.0 125.35 38.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.882 0.372 . . . . 0.0 110.908 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -145.07 155.26 43.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.783 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.41 ' HG3' HG22 ' A' ' 68' ' ' VAL . 29.7 tt0 -121.66 154.57 36.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.003 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.693 ' HB3' HD12 ' A' ' 40' ' ' LEU . 7.3 m -145.76 -169.99 3.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.895 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -139.03 110.8 7.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.898 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 1.056 HD23 HD12 ' A' ' 67' ' ' LEU . 3.7 pp -83.17 -38.26 22.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.85 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.42 ' CB ' ' HD2' ' A' ' 63' ' ' PRO . 2.7 mttm -108.13 169.36 6.69 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.788 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.42 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 47.5 Cg_endo -68.8 -9.39 26.1 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.466 2.11 . . . . 0.0 112.823 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -150.63 49.43 0.87 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.85 0.357 . . . . 0.0 110.941 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.574 HD21 ' CD1' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -159.31 140.66 12.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.113 180.0 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.62 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -101.53 -177.69 3.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.339 179.589 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 1.056 HD12 HD23 ' A' ' 61' ' ' LEU . 3.0 tt -170.02 102.64 0.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.821 0.343 . . . . 0.0 111.493 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.41 HG22 ' HG3' ' A' ' 58' ' ' GLU . 23.4 t -90.04 125.44 42.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.124 178.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.476 ' HD2' HD22 ' A' ' 67' ' ' LEU . 10.0 p90 -145.06 163.36 34.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.864 0.364 . . . . 0.0 111.422 -179.318 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.35 119.3 9.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.754 179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.564 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -85.07 146.32 6.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.9 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.52 103.7 10.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.88 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.3 mmtp -56.72 -21.93 31.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.212 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -47.44 -36.6 10.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.804 0.335 . . . . 0.0 111.312 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -148.36 20.99 1.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.194 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 48.96 73.59 0.22 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.853 0.359 . . . . 0.0 111.059 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.691 HG23 ' HB ' ' A' ' 3' ' ' THR . 99.8 m -132.45 147.4 52.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.915 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.01 91.81 3.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.732 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.42 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 4.3 t80 -89.94 121.11 31.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.833 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.994 HD12 HD21 ' A' ' 67' ' ' LEU . 3.0 mm? -76.76 176.08 8.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.74 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.439 HG23 ' HA ' ' A' ' 69' ' ' TYR . 60.5 t -145.35 -66.34 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.144 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 -123.39 169.07 11.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.962 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.4 HD13 HD11 ' A' ' 14' ' ' LEU . 8.7 tt -176.11 134.66 0.26 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.901 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.62 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 143.86 -141.43 10.28 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.591 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.3 m -134.61 175.62 9.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.907 0.385 . . . . 0.0 110.883 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -82.08 -32.58 30.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.4 m -78.65 -32.9 47.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.95 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.38 -58.77 3.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.905 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.27 -34.54 77.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.83 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.887 179.942 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.862 0.363 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.413 HD23 ' OD1' ' A' ' 76' ' ' ASN . 0.8 OUTLIER 63.32 139.01 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.912 179.951 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.643 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -68.36 -174.9 0.57 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.824 179.977 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -133.98 120.99 37.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.121 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -115.02 163.84 15.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.737 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.5 p -128.28 155.44 44.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.041 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 14.7 m -99.99 -178.37 3.83 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.984 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -74.16 -46.23 43.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.826 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -29.65 69.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.02 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.441 ' CE2' ' HB3' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -58.28 -38.98 78.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.997 179.975 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -61.86 -33.12 73.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.78 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -89.95 -21.63 22.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.139 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.443 ' OD1' HD21 ' A' ' 89' ' ' LEU . 86.7 m-20 -79.59 -25.94 41.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.155 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.1 mp -88.86 -38.44 14.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.26 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 48.6 pttt -57.86 -30.33 65.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.133 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.9 mm -85.19 -29.15 6.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.161 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.771 HD11 ' HA2' ' A' ' 84' ' ' GLY . 18.0 mt -81.22 -36.82 29.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.916 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.6 p -60.14 -26.21 35.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.111 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -90.09 -42.98 10.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.545 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -69.09 -30.88 69.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.534 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 147.87 80.35 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.41 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.937 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 8.9 t80 -157.57 171.88 19.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.941 0.401 . . . . 0.0 110.942 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -145.51 169.42 18.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.862 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.7 mp -97.67 -27.75 14.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.08 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -66.34 -34.18 77.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.952 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.937 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 3.9 pp -64.79 -34.34 78.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.892 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.568 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.6 OUTLIER -75.41 -41.25 56.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.883 179.965 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -72.42 -23.67 61.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.2 mmmt -90.04 -31.68 17.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.333 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.553 HG12 ' HA ' ' A' ' 27' ' ' LEU . 12.7 p -80.8 -7.4 10.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.865 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 27' ' ' LEU . 43.5 t -53.94 -42.02 51.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-O 120.778 0.323 . . . . 0.0 111.125 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.81 -27.0 72.33 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.379 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -87.2 -19.41 28.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.589 0.233 . . . . 0.0 111.159 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.5 mt -77.95 -38.29 45.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.918 0.389 . . . . 0.0 110.983 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.81 -33.03 73.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.244 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 71.2 p -97.87 -31.49 12.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 60.86 58.94 2.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.874 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.475 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -75.35 -56.98 1.77 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.44 -179.876 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 25.0 Cg_endo -62.23 -82.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.063 1.842 . . . . 0.0 112.468 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.418 ' N ' HD22 ' A' ' 40' ' ' LEU . 3.0 mm? 46.56 97.36 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.121 0 CA-C-O 120.873 0.368 . . . . 0.0 111.549 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.37 146.86 4.38 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.371 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.16 -25.35 19.14 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.564 2.176 . . . . 0.0 112.461 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.3 -28.12 61.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.166 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -112.46 -66.79 1.05 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.156 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.3 tttt 63.06 149.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.867 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -76.33 121.46 23.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.841 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -149.22 163.97 23.03 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.899 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -68.35 161.92 42.72 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.532 2.154 . . . . 0.0 112.208 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.548 ' N ' HD12 ' A' ' 49' ' ' LEU . 5.3 mp -95.86 -70.93 0.69 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.03 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.577 ' CB ' HD21 ' A' ' 53' ' ' LEU . 6.1 mmtt -92.45 171.77 8.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.102 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -102.41 116.05 5.39 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.437 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 109.12 26.87 5.04 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.469 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.577 HD21 ' CB ' ' A' ' 50' ' ' LYS . 0.9 OUTLIER -163.95 108.03 0.99 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.745 0.307 . . . . 0.0 110.819 -179.966 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.45 32.29 2.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.968 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -94.72 -32.01 13.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.847 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -108.4 145.3 34.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.884 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -159.02 128.4 5.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.747 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.638 ' HB2' HG22 ' A' ' 68' ' ' VAL . 0.8 OUTLIER -105.88 136.28 45.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.0 -179.8 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 32.0 p -129.2 149.61 50.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.682 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -107.12 86.05 2.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.142 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.509 HD12 ' N ' ' A' ' 62' ' ' LYS . 3.7 pp -59.22 -41.1 87.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.692 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.509 ' N ' HD12 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -111.98 167.67 8.79 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.748 179.738 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.8 -7.59 21.7 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.464 2.109 . . . . 0.0 112.943 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -148.32 42.37 1.0 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.762 0.315 . . . . 0.0 111.161 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 89.7 mt -154.33 135.63 14.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.906 0.384 . . . . 0.0 111.059 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.665 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -102.46 171.71 7.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.448 179.7 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.488 HD23 ' C ' ' A' ' 67' ' ' LEU . 5.6 tt -165.46 100.3 0.71 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.945 0.402 . . . . 0.0 111.356 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.638 HG22 ' HB2' ' A' ' 58' ' ' GLU . 33.6 t -96.18 135.44 30.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.034 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.689 ' HA ' HG23 ' A' ' 81' ' ' VAL . 5.8 p90 -146.0 161.98 38.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.995 0.426 . . . . 0.0 111.35 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -131.47 124.95 31.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.516 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.528 ' N ' HD13 ' A' ' 71' ' ' ILE . 2.9 mm -84.6 143.85 10.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.344 -179.51 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.415 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -127.85 87.72 2.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.714 179.848 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.7 pttt -57.69 -22.21 44.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.217 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -51.7 -32.21 29.12 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.847 0.356 . . . . 0.0 110.987 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -141.27 15.22 2.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.219 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.413 ' OD1' HD23 ' A' ' 2' ' ' LEU . 2.0 t30 47.54 69.91 0.47 Allowed 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 120.84 0.352 . . . . 0.0 111.156 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.643 HG23 ' HB ' ' A' ' 3' ' ' THR . 76.3 m -137.44 146.12 43.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.986 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 34.1 tp -101.0 92.33 4.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.776 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -90.77 114.02 26.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.86 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.441 ' HB3' ' CE2' ' A' ' 10' ' ' PHE . 2.6 mt -71.48 178.96 3.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.928 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.689 HG23 ' HA ' ' A' ' 69' ' ' TYR . 58.7 t -139.13 -70.85 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.105 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -129.99 171.49 12.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.975 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.7 tt -174.9 152.66 1.56 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.872 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.771 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 125.6 -156.99 19.56 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.467 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.3 t -119.99 133.93 55.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.933 0.397 . . . . 0.0 110.885 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -59.76 -47.73 84.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.972 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 25.1 p -64.56 -31.11 72.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.997 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -73.89 -56.51 4.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.443 HD21 ' OD1' ' A' ' 13' ' ' ASP . 3.3 mp -58.06 -30.78 66.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.981 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.944 179.997 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 tpt . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.91 0.386 . . . . 0.0 111.263 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.468 ' H ' HD12 ' A' ' 2' ' ' LEU . 0.7 OUTLIER -98.56 146.92 25.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.85 179.906 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.42 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -60.66 -177.4 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.908 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -128.7 106.28 14.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.12 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -103.07 160.97 14.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.803 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.7 p -139.18 151.47 46.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.026 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 16.7 p -109.3 -168.57 1.35 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.821 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.0 -60.01 2.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.924 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.3 mttt -59.91 -33.36 71.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.906 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.442 ' CE1' ' HB3' ' A' ' 80' ' ' LEU . 75.1 t80 -59.46 -53.5 57.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.935 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.34 -29.96 69.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.028 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -83.47 -6.92 59.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.456 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.557 ' OD1' HD21 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -89.99 -29.76 18.23 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.689 0.281 . . . . 0.0 111.061 -179.816 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 pp -84.46 -38.39 20.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.071 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -59.19 -22.15 60.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.228 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.0 mm -88.98 -29.29 5.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.309 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.833 HD11 ' HA2' ' A' ' 84' ' ' GLY . 11.9 mt -79.79 -32.71 40.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.119 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.5 p -61.97 -30.83 49.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.141 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.65 -37.44 35.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.939 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -77.85 -31.33 51.44 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.869 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 145.58 80.17 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.526 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -153.48 161.16 42.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.831 0.348 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -107.96 172.58 6.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.905 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.582 ' N ' HD12 ' A' ' 24' ' ' LEU . 5.5 mp -99.47 -57.85 2.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.975 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -60.82 -21.5 63.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.053 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.904 ' O ' HG23 ' A' ' 30' ' ' VAL . 1.9 tm? -52.73 -54.07 38.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.881 0.372 . . . . 0.0 111.044 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 tt -61.02 -46.32 91.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.827 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.681 ' O ' HG22 ' A' ' 31' ' ' VAL . 4.8 m-85 -60.65 -25.09 66.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.998 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.68 -29.43 22.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.001 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 26' ' ' LEU . 25.6 t -67.76 -24.55 30.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.309 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.681 HG22 ' O ' ' A' ' 28' ' ' TYR . 32.1 m -48.02 -38.95 8.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.852 0.358 . . . . 0.0 111.38 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.23 -27.9 65.98 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.456 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -90.12 -22.45 21.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.662 0.268 . . . . 0.0 111.15 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.3 mt -69.33 -33.08 72.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.833 0.349 . . . . 0.0 110.93 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.75 -32.96 60.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.136 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.0 p -88.67 -46.24 9.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.667 ' C ' HD11 ' A' ' 40' ' ' LEU . 56.5 mt-10 62.03 55.61 2.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.861 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -93.86 -53.19 0.25 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.225 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -84.63 -88.89 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.49 2.126 . . . . 0.0 112.588 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.667 HD11 ' C ' ' A' ' 37' ' ' GLU . 0.4 OUTLIER 55.57 35.88 26.06 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.889 0.376 . . . . 0.0 111.134 179.934 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.585 ' HB1' ' HE2' ' A' ' 43' ' ' LYS . . . 60.14 109.4 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.069 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.82 -25.98 38.85 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.365 2.044 . . . . 0.0 112.414 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.585 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 3.3 pttt -66.78 -31.12 71.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.006 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -103.74 -39.3 6.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.933 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.5 mttm 63.61 127.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.879 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -61.39 146.57 47.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.017 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -160.13 150.7 15.38 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.826 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.41 ' HA ' ' HA ' ' A' ' 57' ' ' ARG . 17.9 Cg_endo -60.04 -78.71 0.01 OUTLIER 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.5 2.133 . . . . 0.0 112.36 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.538 HD12 ' O ' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -167.87 -73.96 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.89 0.376 . . . . 0.0 110.914 -179.949 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.2 mttm -157.42 114.42 3.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.879 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 64.73 -117.26 10.16 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.523 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.15 -140.46 0.16 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.484 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 13.1 mt 60.7 101.65 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.853 0.358 . . . . 0.0 110.827 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.0 mttp -109.16 -22.61 12.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.172 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.3 -32.93 67.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.949 0.404 . . . . 0.0 110.759 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.538 ' O ' HD12 ' A' ' 49' ' ' LEU . 20.9 m-85 -105.31 118.2 35.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.758 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.41 ' HA ' ' HA ' ' A' ' 48' ' ' PRO . 23.4 mtp180 -142.63 155.07 44.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.018 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.542 ' HB2' HG22 ' A' ' 68' ' ' VAL . 0.4 OUTLIER -129.79 143.14 50.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.839 179.972 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 21.1 m -134.94 177.43 7.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.837 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -130.18 83.4 2.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.958 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.738 HD22 HD12 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -55.92 -34.75 65.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.916 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 65' ' ' LEU . 12.8 mmtt -117.92 163.72 23.2 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.681 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.8 -19.29 30.6 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.654 2.236 . . . . 0.0 112.467 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -148.66 76.38 1.35 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.711 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 62' ' ' LYS . 0.2 OUTLIER -175.57 122.13 0.2 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.139 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.407 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -89.95 157.03 18.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.2 179.464 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.96 HD21 HD12 ' A' ' 80' ' ' LEU . 5.6 tt -153.16 98.35 2.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.902 0.382 . . . . 0.0 111.391 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.542 HG22 ' HB2' ' A' ' 58' ' ' GLU . 34.8 t -94.09 134.1 32.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.284 179.283 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.465 ' HB3' HD13 ' A' ' 80' ' ' LEU . 5.1 p90 -146.26 158.28 43.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.996 0.427 . . . . 0.0 111.312 -179.749 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -135.24 109.35 8.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.637 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.568 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -84.97 141.22 14.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.837 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.69 103.54 10.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.72 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm -59.98 -19.71 53.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.417 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -53.15 -30.34 36.4 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.747 0.308 . . . . 0.0 111.142 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -148.57 19.71 1.04 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.339 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 46.98 75.3 0.13 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.751 0.31 . . . . 0.0 111.283 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.42 HG23 ' HB ' ' A' ' 3' ' ' THR . 96.6 m -133.99 148.48 51.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.942 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.56 91.46 3.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.66 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.441 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 6.1 t80 -89.93 110.96 21.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.92 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.96 HD12 HD21 ' A' ' 67' ' ' LEU . 3.4 mm? -70.41 -178.01 1.62 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.603 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 82.5 t -152.47 -72.42 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.304 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.08 163.85 11.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.914 0.387 . . . . 0.0 111.096 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.464 ' C ' HD13 ' A' ' 83' ' ' LEU . 1.7 tm? -177.09 87.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.926 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.833 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 177.7 -136.61 3.1 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.512 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -140.32 147.86 40.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.744 0.307 . . . . 0.0 110.895 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -59.2 -39.8 83.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.062 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.1 t -75.42 -37.49 60.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.976 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.1 -57.82 5.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.922 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.557 HD21 ' OD1' ' A' ' 13' ' ' ASP . 2.2 mm? -64.78 -62.28 1.66 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.856 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.958 179.949 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.469 ' C ' HD23 ' A' ' 2' ' ' LEU . 2.9 ptp . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 120.863 0.363 . . . . 0.0 111.215 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.833 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.1 OUTLIER -156.76 140.16 15.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.869 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.448 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -73.32 -175.72 2.0 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.793 179.937 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.777 HG12 HG11 ' A' ' 31' ' ' VAL . 4.1 mp -130.31 124.18 57.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.003 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -117.2 162.84 17.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.801 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 44.1 p -126.12 153.67 44.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.951 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.7 t -102.87 177.12 4.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.021 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.7 mtmm -74.02 -43.89 56.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.861 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.7 mmtm -79.07 -28.21 43.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.934 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.581 ' CE2' HD11 ' A' ' 14' ' ' LEU . 31.7 t80 -55.83 -34.33 65.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.978 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.474 ' HA ' HD12 ' A' ' 14' ' ' LEU . 73.6 m-20 -68.12 -31.69 71.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.867 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -78.63 -22.02 47.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.166 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.04 -27.34 33.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.107 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.581 HD11 ' CE2' ' A' ' 10' ' ' PHE . 4.8 mt -81.11 -37.77 28.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.106 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.458 ' HA ' HG12 ' A' ' 18' ' ' VAL . 15.7 ptmt -57.47 -28.85 63.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.129 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.9 mm -78.74 -28.72 14.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.328 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.623 ' CD1' HD21 ' A' ' 65' ' ' LEU . 26.5 mt -87.48 -40.68 14.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.115 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.458 HG12 ' HA ' ' A' ' 15' ' ' LYS . 12.5 p -57.62 -32.17 41.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.2 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt -77.54 -31.17 53.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.935 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -100.37 29.89 4.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.917 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.16 98.44 0.54 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.539 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.521 ' CE1' HD11 ' A' ' 26' ' ' LEU . 55.4 t80 -176.88 97.86 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.82 0.343 . . . . 0.0 110.932 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.406 ' HB3' HD23 ' A' ' 26' ' ' LEU . 4.7 t0 -68.83 160.87 29.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.889 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -94.21 -31.0 14.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.894 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.73 -34.86 73.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.977 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.521 HD11 ' CE1' ' A' ' 22' ' ' PHE . 4.2 pp -61.15 -35.68 77.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.869 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.501 ' HA ' HG12 ' A' ' 30' ' ' VAL . 4.5 tp -77.07 -29.48 55.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.972 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.627 ' O ' HG22 ' A' ' 31' ' ' VAL . 2.5 m-85 -79.49 -25.54 41.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.069 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.34 -32.06 17.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.088 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.501 HG12 ' HA ' ' A' ' 27' ' ' LEU . 13.7 p -71.39 -14.32 17.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.582 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.777 HG11 HG12 ' A' ' 4' ' ' ILE . 18.3 m -51.73 -46.35 38.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.841 0.353 . . . . 0.0 111.365 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.472 ' N ' HG23 ' A' ' 31' ' ' VAL . . . -62.65 -26.39 68.41 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.413 179.859 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -88.71 -19.59 25.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.637 0.256 . . . . 0.0 111.162 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.863 HD21 ' HB3' ' A' ' 61' ' ' LEU . 70.7 mt -72.23 -45.93 58.2 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.842 0.353 . . . . 0.0 111.012 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.446 ' HB2' HD11 ' A' ' 2' ' ' LEU . . . -63.83 -30.59 71.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.23 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 73.5 p -92.38 -35.61 13.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.899 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 60.01 61.59 1.84 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.874 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.47 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 2.5 mt-30 -79.94 -56.67 0.73 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.564 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.47 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 36.5 Cg_endo -66.27 -86.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.029 1.819 . . . . 0.0 112.327 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.484 ' N ' HD22 ' A' ' 40' ' ' LEU . 3.6 mm? 44.63 92.64 0.01 OUTLIER 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.775 0.321 . . . . 0.0 111.625 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.708 ' HB1' ' HD2' ' A' ' 42' ' ' PRO . . . -59.33 165.63 3.69 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.708 ' HD2' ' HB1' ' A' ' 41' ' ' ALA . 11.2 Cg_endo -54.6 -68.95 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.522 2.148 . . . . 0.0 112.196 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.04 -30.65 71.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.753 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -108.56 55.08 0.64 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.693 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.96 -162.22 0.94 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.766 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -113.2 155.2 25.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.869 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 11.3 p-80 -165.6 145.42 5.5 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.825 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -73.03 159.51 47.69 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.597 2.198 . . . . 0.0 112.298 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.604 HD13 ' HB3' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -88.82 -44.97 10.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.893 179.924 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.2 mtmp? 62.86 142.67 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.866 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 110.98 35.78 1.94 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.4 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 101.76 -35.11 5.14 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.442 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -91.14 52.79 2.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.861 0.362 . . . . 0.0 110.832 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.0 mttm -60.07 -34.69 73.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.855 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -65.82 -40.05 91.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.865 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.604 ' HB3' HD13 ' A' ' 49' ' ' LEU . 10.1 m-85 -64.85 157.93 26.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.9 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.2 mtt85 -166.84 137.37 3.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.846 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.407 ' CG ' HG22 ' A' ' 68' ' ' VAL . 31.1 tt0 -109.68 130.66 55.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.904 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.2 p -144.64 175.35 10.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.839 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 55.9 m-70 -129.36 93.06 3.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.838 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.863 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -59.5 -34.56 72.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.906 179.925 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.404 ' HB2' ' HB2' ' A' ' 65' ' ' LEU . 0.1 OUTLIER -110.28 164.99 13.52 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.677 179.955 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.61 -12.69 34.86 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.508 2.139 . . . . 0.0 112.81 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.796 ' O ' HD12 ' A' ' 65' ' ' LEU . 3.1 t0 -149.91 65.38 0.98 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.953 0.406 . . . . 0.0 110.967 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.796 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.1 OUTLIER -163.88 159.29 20.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.853 179.91 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.688 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.3 OUTLIER -116.72 169.77 9.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.831 179.845 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.938 HD13 HD12 ' A' ' 83' ' ' LEU . 15.6 tp -170.01 94.91 0.26 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.031 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.543 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 39.2 t -99.49 69.65 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.897 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.581 ' CD1' HD21 ' A' ' 78' ' ' LEU . 9.2 p90 -89.52 172.89 8.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.057 0.456 . . . . 0.0 111.487 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HB2' ' CD1' ' A' ' 56' ' ' PHE . 2.6 tt0 -142.72 141.06 31.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.641 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.568 ' N ' HD13 ' A' ' 71' ' ' ILE . 2.8 mm -84.79 147.91 5.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.357 -179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.444 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -122.28 87.81 2.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.616 179.522 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.8 mmtt -53.01 -23.87 8.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.388 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -47.18 -33.12 4.95 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.194 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -149.07 20.45 0.98 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.193 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.8 m120 47.29 67.8 0.74 Allowed 'General case' 0 C--O 1.231 0.106 0 CA-C-O 120.848 0.356 . . . . 0.0 111.261 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.448 HG23 ' HB ' ' A' ' 3' ' ' THR . 16.0 m -133.96 150.82 51.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.05 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.833 ' HB2' HD12 ' A' ' 2' ' ' LEU . 1.1 tt -102.34 100.6 10.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.407 179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 2.6 t80 -93.77 112.7 24.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.017 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.576 HD12 ' CE2' ' A' ' 10' ' ' PHE . 23.1 mt -67.39 175.18 2.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.712 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.543 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 73.2 t -149.39 -85.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.414 -179.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.547 ' O ' HD12 ' A' ' 67' ' ' LEU . 2.7 mtt85 -99.0 162.51 13.03 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.917 0.389 . . . . 0.0 111.059 -179.676 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.938 HD12 HD13 ' A' ' 67' ' ' LEU . 1.3 tt -176.5 127.48 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.87 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.688 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 154.87 -166.5 32.46 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.437 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.8 m -118.3 145.56 44.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.854 0.359 . . . . 0.0 110.903 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -62.22 -34.54 76.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.9 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.88 -34.08 77.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.909 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -79.61 -63.98 1.29 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.942 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.5 mp -61.08 -74.75 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.829 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.931 -179.975 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.896 0.379 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.63 HD23 ' HA ' ' A' ' 76' ' ' ASN . 1.7 mp -145.36 154.73 42.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.825 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.96 -177.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.802 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.4 mp -132.14 107.36 12.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.167 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -105.28 167.63 9.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.654 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.8 p -135.87 157.65 46.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.172 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.44 ' HB3' ' CE1' ' A' ' 79' ' ' PHE . 59.8 p -113.86 -176.57 2.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.04 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.9 mmmt -71.16 -58.41 3.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.848 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 26.4 mttp -58.38 -30.36 66.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.876 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CZ ' HD13 ' A' ' 80' ' ' LEU . 93.3 t80 -58.66 -33.72 70.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -66.71 -43.19 84.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.954 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.1 mttt -74.36 -20.12 60.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.237 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.491 ' OD1' HD21 ' A' ' 89' ' ' LEU . 1.3 m-20 -86.47 -27.31 24.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.181 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.89 -36.74 19.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.117 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.483 ' HE3' HD11 ' A' ' 16' ' ' ILE . 1.5 pttt -58.51 -29.06 65.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.209 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.483 HD11 ' HE3' ' A' ' 15' ' ' LYS . 30.2 mm -81.46 -29.16 10.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.285 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.408 HD13 ' CD2' ' A' ' 83' ' ' LEU . 24.3 mt -82.11 -39.94 22.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.076 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.8 p -58.19 -30.44 39.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.163 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.86 -28.99 25.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.932 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -98.45 31.19 2.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.833 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.21 90.57 0.93 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.524 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.577 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 11.1 t80 -175.43 93.76 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.821 0.343 . . . . 0.0 110.863 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -69.81 167.12 17.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.849 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -92.1 -31.01 15.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.962 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.83 -34.61 73.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.577 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 3.9 pp -60.12 -35.51 75.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.938 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.473 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.2 OUTLIER -67.75 -29.71 68.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.897 179.997 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.634 ' O ' HG12 ' A' ' 31' ' ' VAL . 18.6 m-85 -82.27 -28.83 31.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.956 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.2 -32.83 19.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.037 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.464 HG12 ' HA ' ' A' ' 27' ' ' LEU . 14.7 p -68.25 -21.33 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.418 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.634 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.0 p -48.43 -29.29 2.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.437 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.02 -29.35 72.4 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.458 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -89.99 -26.74 20.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.687 0.279 . . . . 0.0 110.956 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.457 HD22 ' CD2' ' A' ' 67' ' ' LEU . 65.8 mt -63.92 -42.77 97.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.943 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.75 -35.98 70.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.067 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.0 p -76.67 -46.61 24.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.89 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.757 ' HA ' HD11 ' A' ' 40' ' ' LEU . 40.2 mt-10 59.34 48.84 9.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.919 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.407 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 2.1 mt-30 -90.27 -52.1 0.33 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.195 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.407 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 73.6 Cg_endo -83.36 -92.77 0.0 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.381 2.054 . . . . 0.0 112.823 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.757 HD11 ' HA ' ' A' ' 37' ' ' GLU . 0.5 OUTLIER 53.82 28.95 8.96 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-O 120.801 0.334 . . . . 0.0 111.025 -179.951 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.477 ' HB1' ' HE2' ' A' ' 43' ' ' LYS . . . 66.66 140.77 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.001 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.38 -40.65 2.93 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.511 2.141 . . . . 0.0 112.563 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.477 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -54.09 -42.06 68.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.114 -179.754 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.457 ' CE1' ' HG3' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -146.17 72.21 1.28 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.947 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.4 mttt -56.63 -79.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.984 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.1 t0 -178.4 140.28 0.2 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.752 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 16.9 p-80 -146.54 145.16 22.43 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -74.89 176.67 9.56 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.499 2.133 . . . . 0.0 112.365 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.1 mt -117.74 -175.62 2.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.82 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.81 167.17 30.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.941 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.64 -54.39 0.79 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.343 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.64 36.35 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.549 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.522 HD22 ' HD2' ' A' ' 56' ' ' PHE . 1.0 OUTLIER -137.89 -64.38 0.54 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.769 0.319 . . . . 0.0 110.876 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.6 mtmm 61.09 33.71 19.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.939 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -138.09 -45.7 0.52 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.878 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.522 ' HD2' HD22 ' A' ' 53' ' ' LEU . 24.0 m-85 -60.29 150.98 28.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.92 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 -161.91 142.91 10.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.742 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -125.82 140.31 52.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.145 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.716 ' HB2' HD22 ' A' ' 40' ' ' LEU . 31.6 p -144.31 160.29 41.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.804 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -108.31 82.19 1.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.985 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.482 HD23 ' HB2' ' A' ' 67' ' ' LEU . 3.9 pp -59.76 -33.24 71.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.823 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.573 ' HD2' HD13 ' A' ' 65' ' ' LEU . 1.0 OUTLIER -110.72 170.36 5.37 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.643 179.845 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.44 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 43.4 Cg_endo -68.43 -8.6 23.53 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.431 2.087 . . . . 0.0 112.893 -179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.816 ' O ' HD12 ' A' ' 65' ' ' LEU . 1.4 t0 -158.49 58.79 0.45 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.865 0.364 . . . . 0.0 111.038 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.816 HD12 ' O ' ' A' ' 64' ' ' ASP . 3.4 mp -151.9 150.84 30.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.054 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.692 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -119.22 106.78 12.68 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.501 179.796 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.55 HD11 HD22 ' A' ' 80' ' ' LEU . 40.0 tp -96.28 97.26 9.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.95 0.405 . . . . 0.0 111.479 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.501 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 27.6 t -94.85 123.73 47.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.062 178.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.477 ' CD1' ' CD1' ' A' ' 71' ' ' ILE . 2.4 p90 -140.8 177.71 7.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.915 0.388 . . . . 0.0 111.285 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.83 106.49 4.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.643 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.614 HG23 HD22 ' A' ' 2' ' ' LEU . 1.5 mp -84.96 137.85 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.896 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.401 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -118.01 101.72 8.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.568 179.739 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.6 ptpp? -60.19 -20.72 59.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.279 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.65 -32.01 49.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.838 0.352 . . . . 0.0 111.025 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -145.21 17.14 1.54 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.273 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.63 ' HA ' HD23 ' A' ' 2' ' ' LEU . 21.2 m120 46.92 74.46 0.15 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.789 0.328 . . . . 0.0 111.336 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.401 ' HB ' ' CG ' ' A' ' 72' ' ' LYS . 98.6 m -134.08 139.48 45.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.925 0.393 . . . . 0.0 110.955 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.06 94.36 5.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.639 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.44 ' CE1' ' HB3' ' A' ' 7' ' ' SER . 3.4 t80 -92.2 112.88 24.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.986 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.55 HD22 HD11 ' A' ' 67' ' ' LEU . 16.1 mt -71.66 171.07 12.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.707 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.501 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 92.7 t -147.65 -65.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.084 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -115.73 166.03 12.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.06 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.549 HD23 HD23 ' A' ' 65' ' ' LEU . 0.9 OUTLIER -178.92 119.73 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.885 179.899 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.692 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 143.63 -168.53 26.3 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.449 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.497 ' O ' HD23 ' A' ' 89' ' ' LEU . 8.1 t -100.32 172.59 7.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.852 0.358 . . . . 0.0 110.972 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -79.04 -40.46 31.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.857 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.7 m -74.26 -31.35 62.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.871 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.15 -31.86 70.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.85 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.497 HD23 ' O ' ' A' ' 85' ' ' SER . 3.1 mm? -76.19 -75.33 0.19 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.785 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.922 -179.977 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 mtm . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.84 0.353 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 mt -132.42 132.88 43.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.551 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -60.19 -175.47 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.763 -179.971 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -132.04 118.13 35.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.073 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -111.79 168.65 9.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.896 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.6 p -143.45 148.41 36.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.999 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 6.9 p -109.81 -171.1 1.77 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.903 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm -79.78 -33.92 40.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.668 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.407 ' HA ' ' CD ' ' A' ' 12' ' ' LYS . 4.5 mttp -80.5 -26.45 38.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.934 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.596 ' HZ ' HD11 ' A' ' 27' ' ' LEU . 35.9 t80 -72.01 -30.63 65.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.934 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.12 -39.38 49.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.128 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.407 ' CD ' ' HA ' ' A' ' 9' ' ' LYS . 2.2 ptmm? -75.74 -13.14 60.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.421 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -90.11 -32.33 16.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.686 0.279 . . . . 0.0 111.056 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.405 HD12 HD12 ' A' ' 83' ' ' LEU . 1.3 tp -79.48 -40.17 30.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.165 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -57.4 -23.28 48.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.234 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.9 mm -86.05 -29.86 6.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.172 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.445 HD11 ' CA ' ' A' ' 84' ' ' GLY . 4.3 mt -85.96 -34.02 20.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.934 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.3 p -60.42 -34.91 59.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.1 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.03 -46.09 58.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.844 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -73.15 -30.9 63.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.928 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 146.91 84.91 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.41 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.577 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 8.3 t80 -164.66 99.11 0.79 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.712 0.291 . . . . 0.0 110.882 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.73 166.22 11.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.843 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.3 mp -98.04 -29.99 12.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.859 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.7 -32.64 74.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.957 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.577 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 4.0 pp -59.6 -31.69 69.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.855 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.596 HD11 ' HZ ' ' A' ' 10' ' ' PHE . 0.9 OUTLIER -67.97 -26.66 66.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.066 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.679 ' O ' HG12 ' A' ' 31' ' ' VAL . 32.3 m-85 -79.76 -26.83 40.57 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.058 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.72 -29.64 19.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.16 -179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.535 HG12 ' HA ' ' A' ' 27' ' ' LEU . 14.8 p -74.25 -25.56 19.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.213 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.679 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.6 p -49.03 -29.36 2.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.333 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -67.57 -29.11 73.68 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.342 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -89.99 -32.77 16.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.911 0.386 . . . . 0.0 110.958 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 40.6 mt -68.08 -41.64 81.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.833 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.07 -40.02 94.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.118 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 68.3 p -75.67 -36.68 60.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.876 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.943 ' HA ' HD21 ' A' ' 40' ' ' LEU . 27.5 mt-10 59.8 52.54 5.36 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.863 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -96.42 -52.82 0.22 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.595 -179.772 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -81.78 -82.57 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.383 2.055 . . . . 0.0 113.238 -179.214 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.943 HD21 ' HA ' ' A' ' 37' ' ' GLU . 0.6 OUTLIER 48.69 40.72 16.43 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.895 0.378 . . . . 0.0 111.136 -179.506 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.69 132.66 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.085 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.407 ' HA ' ' HD2' ' A' ' 45' ' ' LYS . 70.1 Cg_endo -74.24 -25.26 13.72 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.497 2.131 . . . . 0.0 112.451 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.31 -28.34 38.23 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.071 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -103.19 -61.5 1.4 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.026 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.407 ' HD2' ' HA ' ' A' ' 42' ' ' PRO . 0.0 OUTLIER 63.9 140.38 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.839 -179.958 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.577 ' OD1' HD23 ' A' ' 40' ' ' LEU . 4.2 p-10 -59.7 151.17 25.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.909 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 2.4 p-80 -162.76 146.65 8.97 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.9 157.16 51.89 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.462 2.108 . . . . 0.0 112.366 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.23 -46.44 11.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.839 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 60.81 30.5 19.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.904 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -82.75 -52.46 3.88 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.539 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.73 -40.04 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.504 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.706 HD13 ' CE1' ' A' ' 56' ' ' PHE . 1.3 mt -75.77 -32.97 60.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.799 0.333 . . . . 0.0 110.864 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 43.4 mttp 58.54 22.54 9.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.142 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -119.03 -34.96 3.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.973 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.706 ' CE1' HD13 ' A' ' 53' ' ' LEU . 10.9 m-85 -66.0 176.01 1.83 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.009 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -177.41 130.57 0.16 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.65 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.464 ' HG3' HG22 ' A' ' 68' ' ' VAL . 24.2 tt0 -103.23 137.98 40.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.985 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 15.1 m -141.97 -176.29 4.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.83 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 25.0 m80 -143.26 93.76 2.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.914 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.999 HD22 HD12 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -70.66 -29.55 65.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.902 179.858 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.501 ' HB2' HD13 ' A' ' 65' ' ' LEU . 1.2 mttp -121.69 162.77 34.83 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.809 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.69 -12.76 32.94 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.602 2.202 . . . . 0.0 112.772 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.589 ' O ' HD12 ' A' ' 65' ' ' LEU . 20.6 t70 -148.75 65.7 1.05 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.83 0.348 . . . . 0.0 111.254 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.589 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.8 OUTLIER -163.25 149.61 12.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.025 179.886 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.71 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.3 OUTLIER -115.86 149.01 39.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.633 179.817 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.999 HD12 HD22 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -149.66 93.32 2.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.131 -179.834 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.508 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 38.7 t -95.37 69.4 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.968 0.413 . . . . 0.0 110.794 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.689 ' HD2' HD22 ' A' ' 67' ' ' LEU . 9.9 p90 -89.64 168.64 11.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.457 -179.587 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.591 ' C ' HD12 ' A' ' 71' ' ' ILE . 5.7 pt20 -137.64 141.13 41.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.692 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.591 HD12 ' C ' ' A' ' 70' ' ' GLN . 1.4 mp -108.79 119.67 58.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.792 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.408 ' HB2' ' HG2' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -93.23 99.21 11.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.655 179.831 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.3 mttp -60.73 -28.1 68.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.359 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.408 ' HG2' ' HB2' ' A' ' 72' ' ' LYS . 4.8 pt20 -52.87 -28.36 22.7 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.836 0.351 . . . . 0.0 111.149 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -139.7 10.94 2.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.558 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 46.82 76.14 0.11 Allowed 'General case' 0 N--CA 1.461 0.1 0 CA-C-O 120.838 0.351 . . . . 0.0 111.335 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.551 HG23 ' HB ' ' A' ' 3' ' ' THR . 54.8 m -139.85 150.21 44.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.933 0.397 . . . . 0.0 111.036 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.627 HD23 HG23 ' A' ' 31' ' ' VAL . 23.0 tp -107.14 93.84 4.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.434 179.747 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 4.3 t80 -89.87 107.33 19.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.841 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.557 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 1.9 mt -71.36 173.93 7.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.96 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.508 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 90.5 t -151.92 -84.55 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.203 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.492 ' CZ ' HD13 ' A' ' 66' ' ' LEU . 34.8 ttt180 -83.42 163.28 20.65 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.949 0.404 . . . . 0.0 110.771 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.458 HD13 HD23 ' A' ' 65' ' ' LEU . 1.3 tm? -175.49 95.12 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.889 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.71 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 144.25 -168.67 26.56 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.622 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.9 t -112.96 159.41 19.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.756 0.312 . . . . 0.0 110.97 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -62.43 -39.34 93.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.909 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 23.6 m -71.4 -33.22 69.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.921 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.33 -48.12 65.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.884 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.7 mp -59.3 -29.3 67.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.023 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.248 0.984 0 CA-C-O 118.171 -0.919 . . . . 0.0 110.956 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.616 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.795 0.331 . . . . 0.0 110.922 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.53 -174.5 0.55 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.872 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -130.27 114.66 29.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.992 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.65 164.49 11.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.795 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 32.7 p -134.76 151.3 50.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.943 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.411 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 8.1 t -105.29 -169.52 1.61 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.07 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.0 mtmt -81.59 -56.44 4.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.887 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.2 mtmt -58.85 -30.76 67.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.825 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -63.62 -46.52 85.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.777 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -58.73 -30.8 67.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.963 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.13 -6.04 59.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.55 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.96 -49.67 6.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.817 0.341 . . . . 0.0 111.194 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.468 HD12 HD22 ' A' ' 83' ' ' LEU . 1.3 tp -59.43 -38.3 80.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.338 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.2 ptpp? -56.96 -26.46 59.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.316 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 29.1 mm -85.19 -28.56 6.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.375 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.682 HD11 ' HA2' ' A' ' 84' ' ' GLY . 7.1 mt -86.29 -32.47 21.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.138 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 p -64.49 -31.59 54.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.06 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.14 -40.2 38.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.932 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -77.64 -39.01 46.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.943 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 156.89 89.4 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.479 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -154.56 168.1 27.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.819 0.342 . . . . 0.0 110.876 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -122.01 155.31 35.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.946 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.4 mp -83.77 -50.86 7.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.982 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.2 ttmm -65.02 -21.05 66.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.123 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.595 ' O ' HD13 ' A' ' 26' ' ' LEU . 3.2 tm? -52.85 -43.06 65.78 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.079 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.518 ' O ' HG12 ' A' ' 30' ' ' VAL . 5.8 tp -64.23 -54.24 36.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.866 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.616 ' O ' HG12 ' A' ' 31' ' ' VAL . 14.4 m-85 -62.96 -18.27 62.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.953 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -90.07 -36.99 14.57 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.185 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.518 HG12 ' O ' ' A' ' 27' ' ' LEU . 9.5 p -71.8 -20.99 20.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.451 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.616 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.5 p -49.35 -40.52 14.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.368 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.406 ' N ' HG13 ' A' ' 31' ' ' VAL . . . -59.91 -28.62 66.29 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.354 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -89.98 -22.62 21.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.791 0.329 . . . . 0.0 111.096 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.5 mt -74.5 -35.86 63.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.854 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.05 -31.33 62.83 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.282 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 65.9 p -94.43 -34.7 12.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.937 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.914 ' HA ' HD21 ' A' ' 40' ' ' LEU . 3.2 mt-10 60.1 62.17 1.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.739 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.55 -51.68 0.23 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.857 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -80.49 -80.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.337 2.025 . . . . 0.0 113.349 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.914 HD21 ' HA ' ' A' ' 37' ' ' GLU . 2.0 mm? 46.67 27.95 0.73 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.633 0.254 . . . . 0.0 111.432 -179.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.89 ' HB3' ' HB2' ' A' ' 44' ' ' TYR . . . 59.54 117.25 0.02 OUTLIER Pre-proline 0 CA--C 1.53 0.193 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.232 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -52.99 -41.92 68.09 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.461 2.107 . . . . 0.0 112.589 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.12 -26.76 60.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.32 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.89 ' HB2' ' HB3' ' A' ' 41' ' ' ALA . 3.5 m-85 -87.85 -66.42 0.92 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.839 0.352 . . . . 0.0 110.988 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.01 117.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.2 p-10 -56.1 157.25 4.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.061 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -162.01 155.18 17.42 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.949 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo . . . . . 0 C--N 1.345 0.353 0 C-N-CA 122.528 2.152 . . . . 0.0 112.286 179.995 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 56' ' ' PHE . 4.0 m-20 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.888 0.375 . . . . 0.0 110.908 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.424 ' CD2' ' O ' ' A' ' 55' ' ' ASP . 67.8 m-85 -157.05 122.88 4.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.851 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -143.41 139.89 30.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.719 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.481 ' HG3' HG22 ' A' ' 68' ' ' VAL . 10.8 tt0 -121.51 143.09 49.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.987 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.76 ' HB2' HD12 ' A' ' 40' ' ' LEU . 31.8 p -131.28 -174.33 3.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.693 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.445 ' CE1' HD23 ' A' ' 66' ' ' LEU . 34.8 m-70 -143.14 90.49 2.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.987 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.648 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.1 pp -59.64 -41.28 90.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.721 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.648 ' N ' HD12 ' A' ' 61' ' ' LEU . 0.5 OUTLIER -101.61 166.05 12.94 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.832 179.867 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.0 -11.86 32.9 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.561 2.174 . . . . 0.0 112.594 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.52 ' O ' HD12 ' A' ' 65' ' ' LEU . 0.8 OUTLIER -145.57 48.18 1.26 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.8 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.52 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.1 OUTLIER -156.68 132.19 9.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.168 -179.85 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.621 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -99.03 177.81 5.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.247 179.48 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.491 HD23 ' C ' ' A' ' 67' ' ' LEU . 5.7 tt -166.37 99.11 0.6 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.899 0.38 . . . . 0.0 111.403 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.481 HG22 ' HG3' ' A' ' 58' ' ' GLU . 16.4 t -90.0 136.41 23.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.115 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.879 ' HA ' HG23 ' A' ' 81' ' ' VAL . 7.3 p90 -153.03 169.69 22.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.925 0.393 . . . . 0.0 111.447 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -140.01 123.58 17.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.68 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.513 ' N ' HD13 ' A' ' 71' ' ' ILE . 2.9 mm -84.82 150.28 4.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.329 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.425 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -134.48 87.06 2.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.76 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -21.14 43.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.213 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -50.85 -31.34 16.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.753 0.311 . . . . 0.0 111.021 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -144.0 17.48 1.76 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.201 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 47.99 71.91 0.31 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.809 0.337 . . . . 0.0 111.286 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.425 ' HB ' ' CG ' ' A' ' 72' ' ' LYS . 55.4 m -138.21 145.77 41.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.022 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.616 ' HB2' HD12 ' A' ' 2' ' ' LEU . 1.0 OUTLIER -105.2 95.15 5.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.669 179.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.411 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.1 t80 -92.16 115.68 28.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.014 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.406 ' O ' ' CE1' ' A' ' 79' ' ' PHE . 20.0 mt -76.19 168.3 20.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.673 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.879 HG23 ' HA ' ' A' ' 69' ' ' TYR . 48.0 t -131.85 -68.94 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.086 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -128.16 167.06 17.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.951 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.468 HD22 HD12 ' A' ' 14' ' ' LEU . 9.7 tt -171.9 134.75 0.79 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.834 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.682 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 143.28 -149.51 21.44 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.581 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.8 150.08 48.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.818 0.342 . . . . 0.0 110.804 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -59.99 -43.36 95.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.824 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.7 p -70.82 -32.96 70.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.92 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.49 -56.59 6.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.861 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.0 mp . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.856 179.987 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.448 HD23 ' HB3' ' A' ' 76' ' ' ASN . 1.4 mt . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.851 0.357 . . . . 0.0 110.76 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.507 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -60.13 -176.47 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.829 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.444 ' N ' HD12 ' A' ' 4' ' ' ILE . 4.3 mp -128.5 113.93 31.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.171 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.425 ' O ' HD12 ' A' ' 80' ' ' LEU . 4.3 mm-40 -114.29 165.83 12.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.763 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 63.0 p -132.57 162.42 31.33 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.023 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.418 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 1.0 OUTLIER -118.64 -176.53 3.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.918 -179.948 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.68 -47.36 32.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.856 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.9 mttt -67.52 -34.56 77.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.857 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.53 ' CE2' HD13 ' A' ' 80' ' ' LEU . 60.9 t80 -63.22 -31.22 72.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -69.29 -53.38 20.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.91 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -13.33 61.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.318 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.426 ' OD2' HD21 ' A' ' 89' ' ' LEU . 0.7 OUTLIER -82.15 -29.2 31.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.774 0.321 . . . . 0.0 110.998 -179.956 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.58 -31.71 63.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.983 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.411 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -62.71 -26.48 68.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.058 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.1 mm -81.48 -29.74 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.21 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.696 HD21 ' HA2' ' A' ' 84' ' ' GLY . 3.3 mm? -84.51 -36.25 22.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.081 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.411 HG12 ' HA ' ' A' ' 15' ' ' LYS . 11.8 p -63.81 -33.75 63.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.133 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.7 tptt -71.23 -36.35 71.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -87.6 -24.25 24.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.961 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 138.3 94.69 0.32 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.354 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.836 ' CE1' HD11 ' A' ' 26' ' ' LEU . 50.5 t80 -167.64 125.56 1.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.82 0.343 . . . . 0.0 110.988 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.479 ' C ' HD22 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -94.95 -176.44 3.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.7 -179.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.507 HD22 ' N ' ' A' ' 24' ' ' LEU . 3.5 mm? -111.73 -32.14 6.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.95 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.57 -29.87 68.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.957 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.836 HD11 ' CE1' ' A' ' 22' ' ' PHE . 4.2 pp -72.9 -31.33 64.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.992 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.616 HD12 ' CZ ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -72.67 -26.48 61.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.023 179.976 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.497 ' O ' HG12 ' A' ' 31' ' ' VAL . 6.7 m-85 -86.3 -29.31 23.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.897 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.19 -32.53 19.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.969 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.6 p -62.21 -18.56 20.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.267 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.497 HG12 ' O ' ' A' ' 28' ' ' TYR . 11.6 p -50.97 -43.41 25.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.755 0.312 . . . . 0.0 111.26 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.463 ' N ' HG13 ' A' ' 31' ' ' VAL . . . -59.19 -28.12 63.71 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.355 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.7 m-20 -89.96 -24.26 21.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.796 0.331 . . . . 0.0 111.006 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 68.4 mt -72.51 -34.01 67.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.942 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.96 -39.06 30.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.232 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.0 p -83.88 -38.99 20.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.886 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.749 ' HB3' HD11 ' A' ' 40' ' ' LEU . 8.4 mt-10 59.71 66.69 0.96 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.925 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.403 ' CB ' ' HD3' ' A' ' 39' ' ' PRO . 0.5 OUTLIER -94.56 -53.11 0.24 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.16 -179.912 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.403 ' HD3' ' CB ' ' A' ' 38' ' ' GLN . 60.8 Cg_endo -85.82 -88.97 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.611 2.207 . . . . 0.0 112.81 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.749 HD11 ' HB3' ' A' ' 37' ' ' GLU . 0.4 OUTLIER 59.32 21.25 9.49 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.67 0.272 . . . . 0.0 111.038 -179.898 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.642 ' HB1' ' HE3' ' A' ' 43' ' ' LYS . . . 63.31 128.73 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.002 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.17 -23.55 21.08 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.426 2.084 . . . . 0.0 112.476 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.642 ' HE3' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.35 -30.63 42.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.069 -179.954 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.419 ' HB3' ' CD2' ' A' ' 60' ' ' HIS . 59.2 m-85 -101.56 -58.04 1.96 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.077 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.7 mttt 62.52 149.64 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.883 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -92.13 161.47 14.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.87 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -159.25 158.73 28.64 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.914 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.45 ' HA ' ' HB3' ' A' ' 57' ' ' ARG . 68.2 Cg_endo . . . . . 0 C--N 1.344 0.323 0 C-N-CA 122.654 2.236 . . . . 0.0 112.787 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.801 0.334 . . . . 0.0 110.833 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -84.86 138.79 32.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.868 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.45 ' HB3' ' HA ' ' A' ' 48' ' ' PRO . 0.5 OUTLIER -156.73 155.21 31.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.887 -179.934 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.547 ' HB2' HG22 ' A' ' 68' ' ' VAL . 33.3 tt0 -130.15 133.87 46.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.972 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 28.9 p -119.09 -172.04 2.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.798 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.419 ' CD2' ' HB3' ' A' ' 44' ' ' TYR . 68.7 m-70 -140.5 79.9 1.73 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.887 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.504 ' CD2' HD12 ' A' ' 67' ' ' LEU . 1.1 pp -55.91 -50.63 70.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.866 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.489 ' N ' HD12 ' A' ' 61' ' ' LEU . 6.7 mttt -95.15 167.69 12.43 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.705 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 38.2 Cg_endo -66.66 -12.78 37.25 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.545 2.163 . . . . 0.0 112.604 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.855 ' O ' HD12 ' A' ' 65' ' ' LEU . 5.9 t70 -150.92 51.74 0.86 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.677 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.855 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.4 OUTLIER -156.5 130.47 8.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.065 -179.823 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.467 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -104.21 160.92 14.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.295 179.555 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.504 HD12 ' CD2' ' A' ' 61' ' ' LEU . 5.1 tt -148.78 102.62 3.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.854 0.359 . . . . 0.0 111.344 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.547 HG22 ' HB2' ' A' ' 58' ' ' GLU . 25.7 t -90.01 128.78 41.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.231 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.804 ' HA ' HG23 ' A' ' 81' ' ' VAL . 12.1 p90 -150.08 165.94 31.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.909 0.385 . . . . 0.0 111.13 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -145.95 124.38 12.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.858 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.569 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -90.39 151.85 3.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.893 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.414 ' HB2' ' CG ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -120.62 104.0 9.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.733 179.758 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.76 -24.53 64.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.374 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.414 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 1.5 pt20 -53.22 -33.9 54.81 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.089 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -142.95 15.5 1.92 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.444 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.448 ' HB3' HD23 ' A' ' 2' ' ' LEU . 6.9 m-20 46.12 74.32 0.15 Allowed 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.78 0.324 . . . . 0.0 111.332 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.507 HG23 ' HB ' ' A' ' 3' ' ' THR . 98.8 m -136.08 140.34 43.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.933 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.512 HD21 ' CD2' ' A' ' 69' ' ' TYR . 0.6 OUTLIER -95.82 90.51 5.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.686 179.919 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.418 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 2.9 t80 -90.0 106.94 18.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.916 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.53 HD13 ' CE2' ' A' ' 10' ' ' PHE . 3.4 mt -64.53 169.46 4.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.767 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.804 HG23 ' HA ' ' A' ' 69' ' ' TYR . 42.5 t -131.86 -69.81 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.174 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.8 mmm-85 -132.98 178.57 6.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.847 0.356 . . . . 0.0 111.101 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.41 HD12 ' HG ' ' A' ' 67' ' ' LEU . 7.7 tt -177.89 144.34 0.35 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.93 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.696 ' HA2' HD21 ' A' ' 17' ' ' LEU . . . 139.72 -131.72 5.28 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.576 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 39.3 t -147.98 147.12 29.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.769 0.319 . . . . 0.0 110.938 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -59.69 -30.95 69.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.838 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.2 m -78.87 -37.04 41.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.87 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -68.52 -55.43 11.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.854 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.426 HD21 ' OD2' ' A' ' 13' ' ' ASP . 4.3 mp . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.622 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.795 0.331 . . . . 0.0 110.838 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.493 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -57.73 -177.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.039 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.9 mp -131.64 130.43 62.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.055 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -121.57 165.94 14.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.803 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 43.1 p -127.43 160.14 32.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.026 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.421 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 0.5 OUTLIER -117.32 -176.37 2.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.912 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 ptpt -76.78 -47.14 22.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.857 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.7 mtpt -67.96 -31.18 70.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.775 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.709 ' CE1' HD23 ' A' ' 14' ' ' LEU . 56.2 t80 -59.65 -39.36 84.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.87 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.85 -34.51 78.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.939 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 mttm -78.54 -24.73 45.5 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.158 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.556 ' OD1' HD11 ' A' ' 89' ' ' LEU . 3.8 m-20 -87.72 -28.58 21.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.109 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.709 HD23 ' CE1' ' A' ' 10' ' ' PHE . 0.1 OUTLIER -80.37 -28.41 38.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.14 -179.832 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 11.8 pttt -70.83 -28.53 64.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.267 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 28.4 mm -83.21 -45.17 18.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.312 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.545 HD12 HD13 ' A' ' 83' ' ' LEU . 5.4 mt -63.07 -40.35 97.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.012 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.433 HG12 ' O ' ' A' ' 14' ' ' LEU . 11.7 p -64.27 -29.85 48.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.106 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -77.33 -37.51 52.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.903 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -82.24 -49.25 10.3 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.899 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 170.26 89.44 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.486 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.848 ' CE1' HD11 ' A' ' 26' ' ' LEU . 56.0 t80 -174.34 151.69 1.65 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.859 0.362 . . . . 0.0 110.856 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -126.7 159.2 34.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.908 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -89.46 -29.42 19.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.005 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -58.31 -41.49 84.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.896 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.848 HD11 ' CE1' ' A' ' 22' ' ' PHE . 3.9 pp -66.45 -31.34 72.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.861 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.526 ' HA ' HG12 ' A' ' 30' ' ' VAL . 5.3 tt -66.77 -28.37 68.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.041 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.549 ' O ' HG12 ' A' ' 31' ' ' VAL . 0.3 OUTLIER -78.84 -30.05 45.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.939 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -84.28 -35.58 23.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.065 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.526 HG12 ' HA ' ' A' ' 27' ' ' LEU . 14.6 p -69.63 -11.95 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.499 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.549 HG12 ' O ' ' A' ' 28' ' ' TYR . 11.7 p -50.83 -41.57 21.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.858 0.361 . . . . 0.0 111.261 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.418 ' N ' HG13 ' A' ' 31' ' ' VAL . . . -69.68 -28.37 72.23 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.297 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -84.66 -19.91 32.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.715 0.293 . . . . 0.0 111.21 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.524 HD21 ' CD2' ' A' ' 61' ' ' LEU . 79.3 mt -70.88 -45.38 64.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.798 0.332 . . . . 0.0 110.956 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.22 -50.17 66.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.242 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.8 p -75.26 -37.05 61.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.928 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 61.09 54.69 3.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.903 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.451 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 3.5 mt-30 -79.42 -52.59 1.13 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.31 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.451 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 56.0 Cg_endo -73.09 -88.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.065 1.843 . . . . 0.0 112.544 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.0 mp 51.95 -178.49 0.02 OUTLIER 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.758 0.313 . . . . 0.0 111.077 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.4 ' HB3' ' CD2' ' A' ' 44' ' ' TYR . . . -122.17 114.74 30.54 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.161 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.13 71.1 2.27 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.5 2.133 . . . . 0.0 112.299 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.4 ' HD3' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -168.75 -41.0 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.959 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.423 ' HB2' ' CG ' ' A' ' 60' ' ' HIS . 16.2 m-85 -85.54 5.47 31.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.42 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp 62.52 145.98 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.888 0.375 . . . . 0.0 110.978 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -156.04 109.3 2.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.874 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.439 ' CG ' ' HD2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -169.8 167.01 5.31 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.744 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.439 ' HD2' ' CG ' ' A' ' 47' ' ' HIS . 43.1 Cg_endo . . . . . 0 C--N 1.345 0.358 0 C-N-CA 122.514 2.143 . . . . 0.0 112.306 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.701 0.286 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -69.28 133.09 47.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.009 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 21.4 mtp180 -150.75 150.83 31.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.743 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -139.17 120.87 15.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.883 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.1 p -127.82 150.78 49.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.875 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.423 ' CG ' ' HB2' ' A' ' 44' ' ' TYR . 10.8 m-70 -102.44 78.43 1.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.999 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.728 HD12 ' HG2' ' A' ' 62' ' ' LYS . 2.2 pp -58.99 -33.25 70.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.974 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.728 ' HG2' HD12 ' A' ' 61' ' ' LEU . 1.1 mmmm -127.61 159.66 64.78 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.713 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.54 122.71 12.12 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.649 2.232 . . . . 0.0 112.273 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 61.7 39.85 13.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.971 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -138.36 104.04 5.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.914 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.688 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -95.72 123.28 39.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.554 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.967 HD21 HD12 ' A' ' 80' ' ' LEU . 7.9 tt -117.82 99.51 6.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.945 0.402 . . . . 0.0 111.168 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.561 HG23 ' HB3' ' A' ' 82' ' ' ARG . 16.3 t -89.79 138.68 18.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.081 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.628 ' HA ' HG23 ' A' ' 81' ' ' VAL . 40.0 p90 -147.09 -178.07 6.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.086 0.469 . . . . 0.0 111.57 -179.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -162.1 111.45 1.49 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.574 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.542 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -84.7 146.62 6.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.058 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.06 103.95 11.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.742 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.08 -22.21 26.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.328 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -47.49 -36.65 10.54 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.289 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -148.26 21.03 1.08 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.268 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 26.4 m-20 48.27 71.92 0.31 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.914 0.387 . . . . 0.0 111.117 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.493 HG23 ' HB ' ' A' ' 3' ' ' THR . 99.7 m -128.71 147.54 50.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.911 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.622 ' HB2' HD12 ' A' ' 2' ' ' LEU . 0.7 OUTLIER -102.5 92.63 4.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.727 179.844 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.421 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 2.1 t80 -91.19 102.7 15.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.872 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.967 HD12 HD21 ' A' ' 67' ' ' LEU . 3.6 mm? -63.65 167.21 6.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.716 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.628 HG23 ' HA ' ' A' ' 69' ' ' TYR . 59.3 t -137.92 -66.62 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.971 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.561 ' HB3' HG23 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -114.39 163.34 15.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.974 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.766 HD23 HD12 ' A' ' 67' ' ' LEU . 3.1 tm? -176.38 91.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.826 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.688 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 172.53 -152.29 16.31 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.667 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.3 t -127.0 141.71 51.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.856 0.36 . . . . 0.0 110.805 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -59.39 -30.16 68.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.891 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.15 -31.47 30.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.906 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -69.12 -48.86 61.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.923 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.556 HD11 ' OD1' ' A' ' 13' ' ' ASP . 3.6 mp . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.882 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.529 HD23 ' HA ' ' A' ' 76' ' ' ASN . 2.6 mp . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.769 0.318 . . . . 0.0 110.823 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.465 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -59.45 -177.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.836 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.9 mp -128.76 123.01 58.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.039 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -121.05 166.02 14.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.79 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 41.3 p -134.4 150.72 50.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.985 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.414 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 2.6 t -105.49 178.32 4.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.005 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.21 -47.11 65.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.807 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -68.46 -31.94 71.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.742 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.539 ' CZ ' HD13 ' A' ' 80' ' ' LEU . 85.2 t80 -64.02 -41.84 97.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.892 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -60.3 -52.71 64.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.935 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.2 ptmt -69.71 -12.41 61.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.26 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.659 ' OD1' HD21 ' A' ' 89' ' ' LEU . 1.8 m-20 -90.05 -24.22 21.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.247 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.925 HD23 HD11 ' A' ' 24' ' ' LEU . 1.2 tp -89.97 -44.68 9.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.384 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.455 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -53.51 -24.64 13.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.413 -179.571 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 29.4 mm -80.67 -28.88 11.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.223 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.71 HD11 ' HA2' ' A' ' 84' ' ' GLY . 25.3 mt -87.06 -38.4 16.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.071 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.545 HG23 ' HA ' ' A' ' 23' ' ' ASP . 12.1 p -59.05 -40.32 80.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.04 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -30.0 69.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.836 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -100.64 28.26 5.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.888 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.68 102.79 0.55 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.673 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.405 ' HB3' ' HA ' ' A' ' 18' ' ' VAL . 53.5 t80 -175.67 -40.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.713 0.292 . . . . 0.0 110.878 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.545 ' HA ' HG23 ' A' ' 18' ' ' VAL . 0.5 OUTLIER 59.41 173.9 0.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.912 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.925 HD11 HD23 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -117.86 17.05 14.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.081 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.02 -33.54 16.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.875 0.369 . . . . 0.0 110.871 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.78 HD12 ' N ' ' A' ' 27' ' ' LEU . 4.3 pp -64.66 -29.62 70.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.977 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.78 ' N ' HD12 ' A' ' 26' ' ' LEU . 3.3 tp -71.75 -36.36 70.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.903 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.488 ' O ' HG22 ' A' ' 31' ' ' VAL . 5.1 m-85 -76.47 -27.65 56.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.874 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.84 -31.57 20.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.986 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.583 HG12 ' O ' ' A' ' 26' ' ' LEU . 14.7 p -78.36 -5.0 7.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.614 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.488 HG22 ' O ' ' A' ' 28' ' ' TYR . 30.0 m -53.03 -42.91 46.41 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-O 120.89 0.376 . . . . 0.0 111.361 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.434 ' N ' HG23 ' A' ' 31' ' ' VAL . . . -63.85 -26.98 70.52 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.432 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.2 m-20 -85.61 -22.4 28.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.632 0.253 . . . . 0.0 111.129 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 75.2 mt -76.54 -48.64 18.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.902 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.09 -36.02 82.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.213 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.5 p -88.16 -42.69 12.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.985 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.629 ' HA ' HD11 ' A' ' 40' ' ' LEU . 15.4 mt-10 61.88 57.29 2.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.876 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -88.72 -51.89 0.38 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.412 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -79.95 -92.93 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.221 1.947 . . . . 0.0 112.703 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.629 HD11 ' HA ' ' A' ' 37' ' ' GLU . 1.0 OUTLIER 55.86 -178.24 0.04 OUTLIER 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.826 0.346 . . . . 0.0 111.074 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.544 ' HB3' ' HD2' ' A' ' 44' ' ' TYR . . . -128.32 106.46 19.47 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.04 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.97 -7.14 20.76 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.425 2.083 . . . . 0.0 112.793 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.2 32.0 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.697 0.284 . . . . 0.0 111.013 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.544 ' HD2' ' HB3' ' A' ' 41' ' ' ALA . 18.1 m-85 -139.95 -79.66 0.3 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.932 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -177.98 37.67 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.922 0.391 . . . . 0.0 110.893 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.405 ' O ' ' CG ' ' A' ' 47' ' ' HIS . 43.3 p-10 -71.99 75.14 0.92 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.876 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.405 ' CG ' ' O ' ' A' ' 46' ' ' ASP . 1.4 m-70 -178.16 170.0 0.89 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.905 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo . . . . . 0 C--N 1.346 0.425 0 C-N-CA 122.599 2.199 . . . . 0.0 112.231 179.98 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.864 0.364 . . . . 0.0 110.72 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -80.61 129.32 34.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.855 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -148.22 133.31 18.26 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.728 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.555 ' HG3' HG22 ' A' ' 68' ' ' VAL . 3.8 tt0 -109.76 146.37 35.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.97 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 21.2 m -149.69 141.95 24.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.772 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.533 ' CE1' HD23 ' A' ' 66' ' ' LEU . 10.0 m-70 -101.97 92.72 4.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.008 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.596 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.0 pp -62.2 -39.88 94.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.755 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.612 ' HD3' HD13 ' A' ' 65' ' ' LEU . 4.1 mttp -104.53 169.14 7.54 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.741 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 56.8 Cg_endo -71.1 -7.91 22.41 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.559 2.172 . . . . 0.0 112.95 -179.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.712 ' C ' HD12 ' A' ' 65' ' ' LEU . 1.1 m-20 -150.6 45.01 0.86 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.864 0.364 . . . . 0.0 111.156 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.712 HD12 ' C ' ' A' ' 64' ' ' ASP . 5.3 mp -158.91 130.21 6.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.152 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.673 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -94.24 -179.41 4.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.28 179.532 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.833 HD21 HD23 ' A' ' 80' ' ' LEU . 6.4 tt -170.09 102.24 0.29 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.836 0.35 . . . . 0.0 111.383 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.555 HG22 ' HG3' ' A' ' 58' ' ' GLU . 22.8 t -95.23 137.33 23.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.444 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.617 ' HA ' HG23 ' A' ' 81' ' ' VAL . 6.1 p90 -147.05 170.55 16.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.982 0.42 . . . . 0.0 111.405 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -143.03 114.2 7.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.553 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.488 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.4 mp -84.89 135.52 24.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.933 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.98 103.79 12.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.85 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.77 -19.85 62.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.153 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -51.65 -36.51 46.45 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.861 0.362 . . . . 0.0 111.042 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -144.99 18.56 1.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.193 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.529 ' HA ' HD23 ' A' ' 2' ' ' LEU . 12.8 m120 47.27 77.24 0.09 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.829 0.347 . . . . 0.0 111.188 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.465 HG23 ' HB ' ' A' ' 3' ' ' THR . 63.7 m -137.39 144.04 42.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.102 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.47 HD13 HD11 ' A' ' 71' ' ' ILE . 38.1 tp -98.61 91.09 4.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.451 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.414 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.1 t80 -89.8 105.82 18.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.888 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.833 HD23 HD21 ' A' ' 67' ' ' LEU . 3.0 mt -64.75 169.26 5.22 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.774 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.617 HG23 ' HA ' ' A' ' 69' ' ' TYR . 74.7 t -136.8 -71.48 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.086 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -118.67 168.44 10.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.932 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.452 HD22 HD12 ' A' ' 14' ' ' LEU . 5.5 tt -176.61 117.37 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.923 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.71 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 158.14 -147.86 16.32 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.497 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.8 136.89 29.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.821 0.343 . . . . 0.0 110.917 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.38 -30.4 66.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.909 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.7 p -76.75 -30.77 56.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.859 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -80.27 -54.84 5.36 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.927 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.659 HD21 ' OD1' ' A' ' 13' ' ' ASP . 4.5 mp . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.772 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.5 mp . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.759 0.314 . . . . 0.0 110.926 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.663 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -68.76 -173.41 0.46 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.792 179.986 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.0 mp -130.2 136.76 57.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.075 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -139.63 161.09 38.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.753 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.6 p -135.36 155.43 50.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.082 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 8.7 p -110.89 -168.7 1.34 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.795 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -81.14 -42.47 20.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.942 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 71.0 mttt -72.25 -41.05 67.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.892 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.808 ' CE1' HD21 ' A' ' 14' ' ' LEU . 14.2 t80 -59.86 -34.39 73.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.805 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -65.61 -31.12 71.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.6 mtpp -87.36 -8.04 57.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.389 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.608 ' CG ' HD21 ' A' ' 89' ' ' LEU . 3.8 m-20 -88.98 -29.48 19.48 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.792 0.329 . . . . 0.0 111.128 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.808 HD21 ' CE1' ' A' ' 10' ' ' PHE . 21.9 mt -84.08 -35.3 23.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.076 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.402 ' HE3' HD11 ' A' ' 16' ' ' ILE . 27.7 pttt -58.7 -29.85 66.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.172 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.402 HD11 ' HE3' ' A' ' 15' ' ' LYS . 29.3 mm -79.89 -39.16 19.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.282 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.57 ' CD2' HD21 ' A' ' 65' ' ' LEU . 3.6 mp -72.31 -41.04 67.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.014 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.407 HG12 ' O ' ' A' ' 14' ' ' LEU . 13.6 p -63.74 -30.14 49.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.232 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -76.55 -33.9 58.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.824 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -83.15 -59.27 2.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.765 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -170.07 63.11 0.17 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.378 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.42 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 1.3 t80 -151.21 172.09 16.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.81 0.338 . . . . 0.0 110.89 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -151.42 144.1 24.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.826 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.0 mp -71.25 -23.78 62.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.043 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -51.73 68.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.073 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.42 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 2.4 pp -58.75 -31.75 68.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.007 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.508 ' HA ' HG12 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -63.24 -31.24 72.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.894 179.914 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -80.72 -26.65 37.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.7 mtpp -87.57 -29.41 21.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.973 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.508 HG12 ' HA ' ' A' ' 27' ' ' LEU . 14.8 p -76.12 -16.88 15.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.471 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.8 t -48.39 -42.06 11.6 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 120.83 0.348 . . . . 0.0 111.356 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.83 -27.5 64.39 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.339 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.9 m-20 -85.32 -22.44 28.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.819 0.343 . . . . 0.0 111.039 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.6 mt -74.26 -33.4 63.28 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.85 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.88 -43.27 62.72 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.087 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 73.3 p -86.26 -39.29 16.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.87 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 60.85 67.96 0.78 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.846 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.93 -53.57 0.26 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.255 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -82.82 -86.58 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 122.287 1.991 . . . . 0.0 112.545 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.45 ' N ' HD12 ' A' ' 40' ' ' LEU . 6.8 mp 55.38 39.44 31.2 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.786 0.327 . . . . 0.0 111.148 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 60.54 100.31 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.206 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.35 62.24 2.73 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.465 2.11 . . . . 0.0 112.404 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.12 -44.6 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.967 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -82.33 -29.68 30.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.9 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.3 mmpp? 62.08 118.7 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.032 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -81.94 154.73 25.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.716 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 12.3 p80 177.09 156.72 0.46 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.869 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo . . . . . 0 C--N 1.343 0.266 0 C-N-CA 122.621 2.214 . . . . 0.0 112.419 179.974 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.861 0.362 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.514 ' CE2' HG21 ' A' ' 81' ' ' VAL . 1.8 m-85 -80.72 174.42 11.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.827 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -175.53 125.73 0.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.837 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -116.03 130.56 56.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.782 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.65 ' SG ' HD23 ' A' ' 67' ' ' LEU . 28.5 p -134.3 -175.68 3.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.971 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.544 ' CE1' HD23 ' A' ' 66' ' ' LEU . 85.8 m-70 -134.67 80.37 1.85 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.014 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.808 HD23 HD22 ' A' ' 67' ' ' LEU . 3.3 pp -57.34 -31.24 65.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.122 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.414 ' HB2' HD12 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -135.6 151.63 74.78 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.984 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -51.81 133.31 44.84 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.522 2.148 . . . . 0.0 112.34 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 59.41 25.55 14.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.011 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.57 HD21 ' CD2' ' A' ' 17' ' ' LEU . 3.3 mp -134.35 117.28 16.19 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.787 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.71 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.1 OUTLIER -90.03 179.35 5.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.717 -179.968 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.966 HD11 HD12 ' A' ' 80' ' ' LEU . 37.8 tp -167.39 100.35 0.51 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.372 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' A' ' 81' ' ' VAL . 41.4 t -95.3 123.33 47.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.893 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.421 ' HA ' HG23 ' A' ' 81' ' ' VAL . 10.3 p90 -138.78 159.5 41.97 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.976 0.417 . . . . 0.0 111.463 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -136.96 118.28 14.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.519 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.489 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.4 mp -84.94 123.63 39.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.921 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.401 ' CD ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -97.03 100.52 12.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.699 179.703 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.89 -22.62 38.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.112 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -49.57 -36.06 22.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.844 0.354 . . . . 0.0 111.049 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -145.39 18.29 1.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.257 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 47.23 71.01 0.35 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.804 0.335 . . . . 0.0 111.217 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.663 HG23 ' HB ' ' A' ' 3' ' ' THR . 97.6 m -130.19 148.68 52.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.065 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.418 ' CD1' HD11 ' A' ' 71' ' ' ILE . 65.0 tp -102.13 90.5 3.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.541 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.432 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 3.5 t80 -89.93 115.77 27.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.017 -179.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.966 HD12 HD11 ' A' ' 67' ' ' LEU . 3.3 mm? -68.97 168.14 14.35 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.706 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.514 HG21 ' CE2' ' A' ' 56' ' ' PHE . 43.9 t -141.0 -58.75 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.98 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 41.5 mmm-85 -131.54 165.49 23.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.842 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.873 HD12 HD13 ' A' ' 67' ' ' LEU . 5.9 tt -177.05 139.1 0.26 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.948 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.71 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 118.85 -143.35 17.39 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.59 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.9 t -127.4 147.74 50.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.806 0.336 . . . . 0.0 110.861 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -59.3 -30.78 68.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.915 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.3 m -87.22 -31.52 20.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -67.7 -31.4 71.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.9 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.608 HD21 ' CG ' ' A' ' 13' ' ' ASP . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.506 HD12 ' N ' ' A' ' 2' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.746 0.308 . . . . 0.0 111.008 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.481 HG22 ' H ' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -56.81 -170.45 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.863 179.872 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.481 ' H ' HG22 ' A' ' 3' ' ' THR . 4.0 mp -130.97 136.22 58.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.89 0.376 . . . . 0.0 111.187 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -128.31 170.05 13.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.644 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.6 p -137.68 165.66 25.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.854 0.359 . . . . 0.0 111.075 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.3 -175.3 3.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.913 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.13 -53.08 13.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.964 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -62.41 -36.29 81.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.913 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -59.56 -33.17 71.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.93 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -70.57 -40.6 73.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.849 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.1 mttt -78.31 -4.94 50.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.337 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.488 ' OD1' HD11 ' A' ' 89' ' ' LEU . 1.6 m-20 -90.08 -56.54 3.18 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.829 0.347 . . . . 0.0 111.173 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -54.67 -36.8 65.0 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.224 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.8 ptpt -58.9 -30.29 67.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.998 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.1 mm -82.58 -30.48 9.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.249 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.429 HD11 ' HA2' ' A' ' 84' ' ' GLY . 69.5 mt -81.78 -39.5 24.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.949 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.7 p -59.74 -33.47 52.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.08 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.1 tttp -78.88 -30.06 44.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.991 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -98.33 29.07 3.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.93 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.09 95.42 0.89 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.603 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.685 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 15.6 t80 -176.66 101.52 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.837 0.351 . . . . 0.0 110.956 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.598 ' C ' HD22 ' A' ' 24' ' ' LEU . 1.9 t0 -60.2 -167.87 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.863 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.598 HD22 ' C ' ' A' ' 23' ' ' ASP . 3.8 mm? -118.7 -39.92 2.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.997 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.3 mttp -66.67 -27.06 67.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.181 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.89 ' O ' HG23 ' A' ' 30' ' ' VAL . 3.9 pp -57.92 -41.85 83.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.045 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.725 ' O ' HG13 ' A' ' 31' ' ' VAL . 2.8 tp -64.46 -30.05 71.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.038 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.655 ' O ' HG22 ' A' ' 31' ' ' VAL . 17.7 m-85 -73.37 -27.63 61.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.144 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.86 -30.63 18.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.054 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.89 HG23 ' O ' ' A' ' 26' ' ' LEU . 34.8 t -75.01 -18.06 16.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.384 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.725 HG13 ' O ' ' A' ' 27' ' ' LEU . 28.1 m -49.47 -27.97 3.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.828 0.347 . . . . 0.0 111.441 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.555 ' O ' HG23 ' A' ' 36' ' ' THR . . . -72.34 -27.39 69.92 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.606 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -86.97 -28.53 22.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.759 0.314 . . . . 0.0 111.077 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.477 HD22 HD13 ' A' ' 67' ' ' LEU . 36.3 mt -65.11 -44.61 88.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.981 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.84 -35.96 67.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.32 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.555 HG23 ' O ' ' A' ' 32' ' ' GLY . 78.0 p -77.24 -45.12 27.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.887 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.516 ' HB3' HD11 ' A' ' 40' ' ' LEU . 18.5 mt-10 60.81 55.97 3.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.794 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.409 ' N ' ' CD ' ' A' ' 39' ' ' PRO . 0.1 OUTLIER -91.72 -52.22 0.29 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.097 -179.799 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.409 ' CD ' ' N ' ' A' ' 38' ' ' GLN . 47.2 Cg_endo -83.48 -78.31 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.422 2.081 . . . . 0.0 112.736 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.593 HD22 ' HB2' ' A' ' 59' ' ' CYS . 0.9 OUTLIER 57.7 24.75 10.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.728 0.299 . . . . 0.0 111.01 -179.89 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.24 138.52 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.096 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.71 -20.88 15.1 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.583 2.189 . . . . 0.0 112.538 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.442 ' HG2' ' CD2' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -97.67 31.58 2.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.11 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.442 ' CD2' ' HG2' ' A' ' 43' ' ' LYS . 72.5 m-85 -157.92 -70.88 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.066 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 5.9 mmmt 63.55 139.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.933 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -73.58 161.94 29.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.939 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -165.08 154.26 11.23 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.867 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo . . . . . 0 C--N 1.344 0.29 0 C-N-CA 122.57 2.18 . . . . 0.0 112.324 179.962 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.802 0.334 . . . . 0.0 110.842 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -87.68 147.92 25.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.765 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -160.79 147.0 14.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.95 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.631 ' OE2' HD22 ' A' ' 66' ' ' LEU . 54.0 tt0 -127.48 117.63 22.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.933 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.593 ' HB2' HD22 ' A' ' 40' ' ' LEU . 30.3 p -115.02 177.48 4.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.843 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -124.05 90.05 3.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.893 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.882 HD23 HD12 ' A' ' 67' ' ' LEU . 3.8 pp -65.82 -32.43 73.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.883 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.511 ' HB2' HD12 ' A' ' 61' ' ' LEU . 1.4 mttp -139.16 165.18 33.89 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.809 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -62.01 130.58 31.38 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.54 2.16 . . . . 0.0 112.153 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 61.14 31.03 19.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.839 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -140.14 118.16 11.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.812 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.7 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -97.6 177.64 5.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.616 179.916 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.96 HD21 HD12 ' A' ' 80' ' ' LEU . 3.9 tt -165.37 102.35 0.73 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.12 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.409 ' O ' ' N ' ' A' ' 81' ' ' VAL . 37.5 t -94.65 124.16 47.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.167 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.653 ' HD2' HD22 ' A' ' 67' ' ' LEU . 5.6 p90 -141.18 157.94 44.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.933 0.397 . . . . 0.0 111.244 -179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -137.26 114.04 10.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.75 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.502 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.3 mp -84.98 131.99 32.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.88 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.424 ' HB2' ' CG ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -106.55 102.42 11.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.801 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.1 mttp -59.33 -23.43 62.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.491 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.424 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 1.1 pt20 -51.26 -33.49 28.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.73 0.3 . . . . 0.0 111.141 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -145.51 17.2 1.49 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.482 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 m120 46.53 72.61 0.22 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.894 0.378 . . . . 0.0 111.256 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.411 ' HB ' ' CG ' ' A' ' 72' ' ' LYS . 85.1 m -131.18 142.93 50.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.921 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.435 ' CD1' HD11 ' A' ' 71' ' ' ILE . 64.4 tp -97.06 90.29 5.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.525 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -91.68 106.35 18.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.899 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.96 HD12 HD21 ' A' ' 67' ' ' LEU . 3.6 mm? -65.43 -177.57 0.43 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.675 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.409 ' N ' ' O ' ' A' ' 68' ' ' VAL . 45.6 t -153.25 -62.99 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.165 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -127.54 166.49 17.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.868 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.568 HD12 ' HG ' ' A' ' 67' ' ' LEU . 1.4 tt -178.26 132.6 0.14 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.856 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.7 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 129.76 -145.82 16.8 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.495 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.6 t -129.41 148.23 51.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.845 0.355 . . . . 0.0 110.871 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -64.34 -39.08 93.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 45.2 p -66.43 -31.23 71.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.865 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.68 -53.04 24.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.893 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.488 HD11 ' OD1' ' A' ' 13' ' ' ASP . 3.9 mp . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.881 0.372 . . . . 0.0 110.899 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.584 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -63.73 -178.88 0.33 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.855 -179.951 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.2 mp -131.46 114.58 26.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.116 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -106.57 168.37 9.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.733 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 76.6 p -137.28 148.96 46.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.067 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.417 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 28.9 t -103.55 -167.94 1.44 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.833 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -84.79 -47.75 10.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.803 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -70.51 -28.08 64.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.976 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -56.98 -30.87 64.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.99 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -75.44 -46.81 30.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.926 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.1 mtpp -66.86 -21.91 66.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.173 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.22 -28.67 23.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.817 0.341 . . . . 0.0 111.099 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.557 ' O ' HG12 ' A' ' 18' ' ' VAL . 0.2 OUTLIER -79.28 -34.9 42.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.037 -179.883 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -56.81 -24.53 51.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.228 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.1 mm -80.36 -45.88 21.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.413 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.487 HD21 HD11 ' A' ' 65' ' ' LEU . 3.8 mp -72.65 -44.47 61.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.125 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.557 HG12 ' O ' ' A' ' 14' ' ' LEU . 13.3 p -56.4 -30.04 29.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.224 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.15 -40.19 22.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.997 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -70.59 -62.61 1.32 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.946 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -178.86 75.35 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.51 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.507 ' CE1' HD21 ' A' ' 26' ' ' LEU . 86.0 t80 -153.03 137.51 16.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.805 0.336 . . . . 0.0 110.869 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.24 119.49 39.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.79 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.596 ' H ' HD23 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -55.46 -23.67 26.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.182 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.5 tttm -59.2 -50.24 74.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.027 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.507 HD21 ' CE1' ' A' ' 22' ' ' PHE . 2.0 pp -57.86 -28.54 64.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.096 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.527 ' HA ' HG12 ' A' ' 30' ' ' VAL . 4.5 tt -64.88 -26.68 68.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.998 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.683 ' O ' HG12 ' A' ' 31' ' ' VAL . 2.4 m-85 -80.38 -28.09 38.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.172 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -87.53 -29.35 21.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.195 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.527 HG12 ' HA ' ' A' ' 27' ' ' LEU . 15.0 p -75.31 -25.73 18.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.328 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.683 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.5 p -47.23 -32.86 2.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.496 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.36 -26.44 74.56 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.454 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -88.5 -23.78 23.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.759 0.314 . . . . 0.0 111.139 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 34.1 mt -69.34 -38.12 78.0 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.922 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.64 -12.16 59.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.623 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.1 p -107.68 -44.55 4.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.839 0.352 . . . . 0.0 110.99 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.657 ' HB3' HD11 ' A' ' 40' ' ' LEU . 3.0 mt-10 60.8 60.78 1.81 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.697 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.402 ' N ' ' CD ' ' A' ' 39' ' ' PRO . 1.1 mt-30 -91.64 -52.05 0.29 Allowed Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.519 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.402 ' CD ' ' N ' ' A' ' 38' ' ' GLN . 65.4 Cg_endo -80.29 -90.64 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 122.348 2.032 . . . . 0.0 112.988 -179.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.657 HD11 ' HB3' ' A' ' 37' ' ' GLU . 0.9 OUTLIER 62.41 -167.54 0.2 Allowed 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.761 0.315 . . . . 0.0 110.716 -179.609 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -112.38 137.41 21.57 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.997 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -73.58 -29.11 11.22 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.526 2.151 . . . . 0.0 112.37 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.71 -29.77 45.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.025 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -97.39 -53.3 3.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.995 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.52 149.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.833 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -97.28 147.31 24.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.86 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -172.82 159.71 3.72 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.953 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo . . . . . 0 C--N 1.344 0.33 0 C-N-CA 122.646 2.231 . . . . 0.0 112.377 -179.996 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.853 0.358 . . . . 0.0 110.719 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -60.27 147.82 38.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.752 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.9 mtt85 -159.28 125.14 4.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.916 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -112.6 108.15 17.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.889 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.5 p -105.36 172.45 6.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.985 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 13.3 m-70 -124.52 83.2 2.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.84 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.76 HD23 HD12 ' A' ' 67' ' ' LEU . 2.2 pp -55.73 -40.78 72.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.032 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.655 ' CG ' HD12 ' A' ' 61' ' ' LEU . 9.1 mmtm -117.54 155.87 49.91 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -48.23 -25.85 7.47 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.733 2.289 . . . . 0.0 112.627 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.679 ' O ' HD12 ' A' ' 65' ' ' LEU . 0.8 OUTLIER -141.04 75.36 1.5 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.816 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.679 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.2 OUTLIER -174.54 119.6 0.23 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.079 -179.85 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.795 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.1 OUTLIER -89.89 151.87 21.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.357 179.708 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.86 HD21 HD23 ' A' ' 80' ' ' LEU . 2.1 tt -145.3 97.58 3.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.919 0.39 . . . . 0.0 111.394 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.546 HG23 ' HB3' ' A' ' 82' ' ' ARG . 37.7 t -92.47 122.0 43.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.785 178.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.649 ' HD2' HD22 ' A' ' 67' ' ' LEU . 5.8 p90 -140.38 162.92 34.15 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.996 0.427 . . . . 0.0 111.412 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -144.26 108.08 4.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.575 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.574 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -84.88 133.65 28.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.927 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.35 100.67 10.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.716 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -58.68 -21.77 55.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.343 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -55.0 -29.89 58.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.79 0.329 . . . . 0.0 111.161 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -144.37 16.12 1.67 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.392 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 46.94 72.1 0.27 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.865 0.364 . . . . 0.0 111.251 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.584 HG23 ' HB ' ' A' ' 3' ' ' THR . 99.0 m -134.83 142.51 46.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.946 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.507 HD13 HG23 ' A' ' 31' ' ' VAL . 1.4 tt -99.64 93.11 5.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.726 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 3.6 t80 -92.2 107.62 19.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.877 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.86 HD23 HD21 ' A' ' 67' ' ' LEU . 2.1 mt -67.13 -179.85 1.04 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.563 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.413 ' N ' ' O ' ' A' ' 68' ' ' VAL . 43.9 t -154.25 -56.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.144 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.546 ' HB3' HG23 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -118.81 163.77 16.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.112 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -177.39 101.08 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.849 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.795 ' O ' HD12 ' A' ' 66' ' ' LEU . . . -178.21 169.43 41.17 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.523 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.3 p -95.48 148.81 22.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.8 0.333 . . . . 0.0 110.841 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -68.63 -30.99 69.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.881 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.1 t -70.07 -39.65 75.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.95 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -76.73 -59.04 2.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.882 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.475 HD11 ' HA3' ' A' ' 84' ' ' GLY . 4.4 mp . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.911 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.558 HD13 ' CB ' ' A' ' 78' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.86 0.362 . . . . 0.0 110.908 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.678 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -74.99 -171.14 1.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.013 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.441 ' H ' HG22 ' A' ' 3' ' ' THR . 4.6 mp -137.06 135.89 47.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.042 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -133.58 162.71 31.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.83 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.428 HG22 HD12 ' A' ' 80' ' ' LEU . 41.0 p -138.09 147.82 44.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.988 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -105.44 171.85 7.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.997 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -43.91 87.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.974 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -65.05 -42.65 94.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.885 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.701 ' CE2' HD13 ' A' ' 80' ' ' LEU . 13.3 t80 -59.22 -37.49 77.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.848 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -58.57 -30.49 67.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.825 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.8 mttp -82.11 -23.83 35.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.997 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.496 ' OD2' HD11 ' A' ' 89' ' ' LEU . 1.0 OUTLIER -79.22 -23.81 43.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.159 -179.895 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.59 HD13 ' CE1' ' A' ' 10' ' ' PHE . 2.1 tp -89.96 -39.38 13.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.247 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.3 -30.43 62.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.125 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.9 mm -82.19 -29.26 9.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.128 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.402 HD11 ' HA2' ' A' ' 84' ' ' GLY . 14.1 mt -79.37 -36.94 38.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.015 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.3 p -65.26 -33.99 67.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.058 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -74.13 -31.3 62.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.963 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -87.67 -56.18 3.46 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.904 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -176.83 78.45 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.545 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -158.25 166.77 31.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.795 0.331 . . . . 0.0 110.819 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -130.99 170.95 13.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.928 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.66 -52.37 3.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.916 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.95 -28.91 68.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.974 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.661 ' O ' HD13 ' A' ' 26' ' ' LEU . 3.4 tm? -58.46 -32.52 68.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.893 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.448 ' HA ' HG12 ' A' ' 30' ' ' VAL . 10.0 tt -77.49 -35.45 53.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.101 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.592 ' O ' HG22 ' A' ' 31' ' ' VAL . 6.4 m-85 -76.52 -23.43 53.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.969 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -88.73 -37.45 15.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.879 0.371 . . . . 0.0 111.002 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.448 HG12 ' HA ' ' A' ' 27' ' ' LEU . 12.1 p -66.08 -15.39 18.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.469 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.592 HG22 ' O ' ' A' ' 28' ' ' TYR . 22.5 m -49.25 -39.29 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.13 0 CA-C-O 120.73 0.3 . . . . 0.0 111.325 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.57 -27.3 63.48 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.485 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -89.81 -31.52 17.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.881 0.372 . . . . 0.0 110.91 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' A' ' 31' ' ' VAL . 65.3 mt -62.3 -46.75 87.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.848 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.88 -33.57 74.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.116 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 76.2 p -81.75 -42.27 20.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.987 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.834 ' HB3' HD11 ' A' ' 40' ' ' LEU . 14.2 mt-10 61.62 45.41 8.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.003 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.443 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 2.4 mt-30 -80.83 -52.3 0.89 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.17 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.443 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 50.4 Cg_endo -73.96 -85.5 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.13 1.887 . . . . 0.0 112.659 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.834 HD11 ' HB3' ' A' ' 37' ' ' GLU . 3.8 mt 59.88 22.87 11.88 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.762 0.315 . . . . 0.0 111.233 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 61.71 119.28 0.02 OUTLIER Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.071 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -75.07 59.49 5.25 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.449 2.099 . . . . 0.0 112.428 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.458 ' HG3' ' CE2' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -153.13 -45.22 0.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.93 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.458 ' CE2' ' HG3' ' A' ' 43' ' ' LYS . 14.9 m-85 -97.78 -49.96 4.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.828 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 63.61 126.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.901 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.583 ' HB2' HD13 ' A' ' 40' ' ' LEU . 17.5 t0 -57.97 132.17 52.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.92 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 41.2 p-80 -139.21 148.59 57.74 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.89 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo . . . . . 0 C--N 1.345 0.355 0 C-N-CA 122.485 2.123 . . . . 0.0 112.329 179.92 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.748 0.309 . . . . 0.0 110.881 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -126.1 153.81 43.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.807 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 29.4 mtt85 -164.0 139.56 6.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.906 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.468 ' HG3' HG22 ' A' ' 68' ' ' VAL . 0.7 OUTLIER -124.78 137.52 54.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.861 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.9 p -140.85 171.62 13.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.894 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.43 ' NE2' HD23 ' A' ' 66' ' ' LEU . 12.1 m-70 -115.69 82.32 1.74 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.828 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.549 ' H ' HD23 ' A' ' 61' ' ' LEU . 1.5 pt? -59.77 -30.41 68.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.032 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.441 ' HB3' HD13 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -136.1 149.99 69.85 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.903 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.605 ' O ' HD12 ' A' ' 65' ' ' LEU . 53.1 Cg_exo -52.31 129.17 30.33 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.583 2.189 . . . . 0.0 112.318 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 62.42 29.96 17.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.931 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.605 HD12 ' O ' ' A' ' 63' ' ' PRO . 2.6 mp -139.72 118.32 12.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.925 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.646 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -89.91 173.07 8.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.535 179.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.476 HD13 HD12 ' A' ' 83' ' ' LEU . 48.0 tp -164.47 99.34 0.81 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.985 0.421 . . . . 0.0 111.474 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.468 HG22 ' HG3' ' A' ' 58' ' ' GLU . 40.0 t -96.76 124.14 49.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.896 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 7.5 p90 -138.48 155.99 47.94 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.034 0.445 . . . . 0.0 111.409 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -130.58 116.07 17.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.455 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.526 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.4 mp -84.85 128.02 39.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.934 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.409 ' HB2' ' CG ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -102.98 101.65 11.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.672 179.818 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.2 mtmt -58.55 -23.15 57.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.255 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.409 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 1.0 OUTLIER -52.9 -32.44 45.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.818 0.342 . . . . 0.0 111.01 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -145.2 16.48 1.53 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.307 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 45.97 71.76 0.27 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.805 0.336 . . . . 0.0 111.448 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.678 HG23 ' HB ' ' A' ' 3' ' ' THR . 98.5 m -131.4 144.73 51.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.145 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.558 ' CB ' HD13 ' A' ' 2' ' ' LEU . 50.8 tp -101.27 89.66 3.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.41 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -89.98 120.79 31.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.804 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.701 HD13 ' CE2' ' A' ' 10' ' ' PHE . 2.2 mt -69.98 179.76 2.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.738 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.423 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 62.1 t -150.28 -66.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.094 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 -127.2 163.07 24.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.993 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.5 HD23 ' N ' ' A' ' 84' ' ' GLY . 5.2 tt -168.86 152.54 5.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.044 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.646 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 121.82 -168.21 14.55 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.47 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 16.0 t -95.51 171.33 8.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.785 0.326 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -80.56 -30.65 37.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.876 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 91.0 p -85.09 -42.65 14.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.016 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -61.55 -38.73 88.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.84 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.496 HD11 ' OD2' ' A' ' 13' ' ' ASP . 3.7 mm? . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.88 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.805 0.336 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.578 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -60.42 -175.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.865 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -131.1 121.18 48.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.115 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -118.64 167.9 11.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.75 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.471 HG22 ' CE2' ' A' ' 10' ' ' PHE . 59.7 p -142.1 151.1 42.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.963 0.411 . . . . 0.0 110.97 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.407 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 0.3 OUTLIER -112.74 -167.03 1.13 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.98 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.77 -49.32 14.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.856 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.9 mttp -61.22 -31.27 71.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.967 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.616 ' HZ ' HD21 ' A' ' 27' ' ' LEU . 16.2 t80 -71.02 -47.07 60.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.939 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.32 -45.24 94.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.931 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.2 pttt -72.61 -16.04 61.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.375 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -84.43 -29.19 26.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.742 0.306 . . . . 0.0 111.108 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.595 HD23 HD22 ' A' ' 83' ' ' LEU . 9.6 mt -80.24 -36.47 34.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.071 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.8 pttt -58.67 -25.69 63.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.137 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.1 mm -85.13 -29.51 6.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.277 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.753 HD11 ' HA2' ' A' ' 84' ' ' GLY . 7.1 mt -82.89 -37.13 24.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.05 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.4 p -58.21 -30.4 39.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.051 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -30.75 34.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.916 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -98.76 31.04 3.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.86 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.01 94.3 0.75 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.571 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.736 ' CE1' HD11 ' A' ' 26' ' ' LEU . 16.1 t80 -175.13 100.61 0.08 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.737 0.303 . . . . 0.0 110.868 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.22 -177.51 0.53 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.905 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 40.3 mt -110.78 -31.32 7.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.963 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.26 -27.85 66.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.06 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.736 HD11 ' CE1' ' A' ' 22' ' ' PHE . 4.2 pp -57.17 -43.74 82.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.038 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.715 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -59.08 -48.25 82.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.974 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.639 ' O ' HG22 ' A' ' 31' ' ' VAL . 14.6 m-85 -62.23 -20.12 63.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.081 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -88.32 -29.96 19.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.999 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 26' ' ' LEU . 34.0 t -81.97 -26.36 9.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.28 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.676 HG13 ' O ' ' A' ' 27' ' ' LEU . 28.1 m -54.26 -31.65 22.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.285 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.24 -32.17 83.22 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.419 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -90.01 -28.4 19.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.673 0.273 . . . . 0.0 110.85 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 72.1 mt -62.23 -39.73 93.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.898 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.37 -41.13 85.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.103 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.3 p -77.85 -36.61 49.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.893 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.82 ' HA ' HD11 ' A' ' 40' ' ' LEU . 51.2 mt-10 61.25 43.71 10.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.053 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.401 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -92.83 -52.67 0.26 Allowed Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.211 -179.898 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.401 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 72.6 Cg_endo -84.12 -91.57 0.0 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.548 2.165 . . . . 0.0 112.783 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.82 HD11 ' HA ' ' A' ' 37' ' ' GLU . 1.3 mt 57.87 36.27 26.17 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.83 0.348 . . . . 0.0 110.876 -179.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 64.0 132.97 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.026 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -77.87 -1.16 11.34 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.571 2.181 . . . . 0.0 112.825 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.441 ' HG2' ' CD2' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -109.51 16.79 22.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.35 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.441 ' CD2' ' HG2' ' A' ' 43' ' ' LYS . 43.6 m-85 -146.49 -65.9 0.29 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.85 0.357 . . . . 0.0 110.871 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.1 mtpp 62.6 121.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.912 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -57.96 143.77 41.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.991 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.448 ' CG ' ' HD2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -154.61 156.33 31.44 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.797 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.448 ' HD2' ' CG ' ' A' ' 47' ' ' HIS . 43.1 Cg_endo . . . . . 0 C--N 1.344 0.342 0 C-N-CA 122.577 2.184 . . . . 0.0 112.332 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 . . . . . 0 N--CA 1.457 -0.104 0 CA-C-O 120.877 0.37 . . . . 0.0 110.802 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -88.42 153.65 21.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.982 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -164.04 147.08 9.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.712 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.529 ' HG3' HG22 ' A' ' 68' ' ' VAL . 4.1 tt0 -131.45 134.2 45.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.993 0.425 . . . . 0.0 111.151 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 25.0 p -125.46 -175.25 3.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.645 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -135.85 81.7 1.9 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.21 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.557 ' H ' HD23 ' A' ' 61' ' ' LEU . 1.3 pt? -59.93 -33.35 71.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.797 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.617 ' CB ' HD12 ' A' ' 65' ' ' LEU . 0.5 OUTLIER -113.6 141.57 26.21 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.341 179.74 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.401 ' HD2' ' HG3' ' A' ' 62' ' ' LYS . 9.4 Cg_endo -52.38 -20.46 11.62 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.651 2.234 . . . . 0.0 112.784 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.603 ' O ' HD23 ' A' ' 65' ' ' LEU . 0.6 OUTLIER -130.25 36.75 3.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.193 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.617 HD12 ' CB ' ' A' ' 62' ' ' LYS . 56.1 mt -151.82 164.86 36.15 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.944 0.402 . . . . 0.0 111.201 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.676 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -126.28 179.81 5.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.125 179.516 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 1.075 HD21 HD12 ' A' ' 80' ' ' LEU . 9.2 tt -170.03 102.92 0.3 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.822 0.344 . . . . 0.0 111.301 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.529 HG22 ' HG3' ' A' ' 58' ' ' GLU . 21.8 t -89.78 138.19 19.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.312 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.6 ' HA ' HG23 ' A' ' 81' ' ' VAL . 14.8 p90 -147.04 177.15 9.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.074 0.464 . . . . 0.0 111.344 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -148.0 123.04 10.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.474 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.525 ' N ' HD13 ' A' ' 71' ' ' ILE . 3.0 mm -84.69 138.41 19.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.342 -179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.412 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -122.77 87.63 2.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.657 179.8 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -22.11 21.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.177 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -46.73 -33.53 4.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.2 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -147.2 20.04 1.23 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.318 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 29.7 m120 48.21 69.33 0.56 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.872 0.368 . . . . 0.0 111.232 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.578 HG23 ' HB ' ' A' ' 3' ' ' THR . 52.2 m -135.1 137.68 43.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.966 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 35.9 tp -94.53 93.22 7.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.591 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.407 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.8 t80 -89.89 111.78 22.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.834 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 1.075 HD12 HD21 ' A' ' 67' ' ' LEU . 3.5 mm? -71.96 171.53 11.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.88 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.6 HG23 ' HA ' ' A' ' 69' ' ' TYR . 66.0 t -137.61 -72.72 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.162 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.0 mmm-85 -116.19 170.56 8.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.922 0.391 . . . . 0.0 111.047 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.872 HD12 HD12 ' A' ' 67' ' ' LEU . 9.4 tt -177.62 135.16 0.18 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.771 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.753 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 146.38 -168.68 27.78 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.558 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -96.47 144.24 26.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.816 0.341 . . . . 0.0 110.812 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -35.41 73.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.948 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 31.9 m -77.01 -47.1 21.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.96 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.46 -51.04 71.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.955 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.863 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.67 HD22 HD12 ' A' ' 78' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.46 0.048 0 CA-C-O 120.815 0.341 . . . . 0.0 110.867 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.448 HG22 ' H ' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -120.4 -171.89 2.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.89 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.448 ' H ' HG22 ' A' ' 3' ' ' THR . 4.3 mp -130.76 126.72 60.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.165 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -124.73 166.49 16.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.846 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 71.3 p -142.0 159.68 41.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.962 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -125.49 172.49 9.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.98 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -44.71 96.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.965 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.6 mttm -62.93 -31.25 72.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.769 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.44 ' CZ ' HD13 ' A' ' 14' ' ' LEU . 76.4 t80 -67.94 -34.88 77.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.839 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -69.77 -30.12 67.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.041 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.85 -21.07 55.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.259 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.744 ' OD1' HD21 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -87.44 -46.36 9.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.807 0.337 . . . . 0.0 111.036 -179.854 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.44 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 1.4 tp -63.43 -37.62 87.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.079 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.3 ptpt -57.44 -22.95 46.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.269 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 26.9 mm -85.88 -36.65 10.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.312 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.835 HD11 ' HA2' ' A' ' 84' ' ' GLY . 63.8 mt -78.58 -35.54 45.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.152 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.0 p -58.16 -33.28 46.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.144 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt -74.87 -30.47 61.33 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.921 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -102.38 30.02 4.84 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.856 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.74 92.53 1.01 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.548 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -176.76 94.96 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.796 0.331 . . . . 0.0 110.861 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.12 -179.06 0.7 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.887 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.2 mp -108.08 -31.74 7.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.851 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.42 -26.03 63.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.042 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.644 ' O ' HG23 ' A' ' 30' ' ' VAL . 3.9 pp -56.6 -38.3 71.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.132 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.662 HD21 HD11 ' A' ' 80' ' ' LEU . 4.4 tt -64.1 -37.35 87.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.918 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.656 ' O ' HG12 ' A' ' 31' ' ' VAL . 0.2 OUTLIER -59.63 -27.0 65.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.031 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.68 -31.67 20.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.885 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 26' ' ' LEU . 24.6 t -67.07 -21.76 28.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.342 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.656 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.2 p -49.98 -29.35 5.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.286 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -71.1 -38.54 63.59 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.46 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -79.81 -26.15 40.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.804 0.335 . . . . 0.0 110.911 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.592 ' HG ' HG12 ' A' ' 30' ' ' VAL . 77.6 mt -73.49 -29.06 62.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.946 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.33 -29.72 42.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.251 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.0 p -96.38 -38.88 9.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.048 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.936 ' HA ' HD21 ' A' ' 40' ' ' LEU . 21.4 mt-10 60.89 72.71 0.51 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.792 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.402 ' CB ' ' HD3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -100.08 -54.31 0.17 Allowed Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.634 -179.574 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.402 ' HD3' ' CB ' ' A' ' 38' ' ' GLN . 49.5 Cg_endo -83.69 -79.26 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.305 2.004 . . . . 0.0 113.111 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.936 HD21 ' HA ' ' A' ' 37' ' ' GLU . 1.2 mm? 46.7 40.73 9.11 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.846 0.355 . . . . 0.0 111.444 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.637 ' HB1' ' HD3' ' A' ' 43' ' ' LYS . . . 63.2 127.31 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.254 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 41' ' ' ALA . 25.6 Cg_exo -62.43 -25.63 76.19 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.494 2.129 . . . . 0.0 112.418 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.637 ' HD3' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -76.1 -30.94 58.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.325 -179.671 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -108.15 -62.6 1.43 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.054 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.9 mttt 63.72 31.35 14.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.804 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.7 t70 59.89 161.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.944 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -171.26 161.26 5.28 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.766 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--N 1.344 0.317 0 C-N-CA 122.551 2.167 . . . . 0.0 112.322 179.912 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 . . . . . 0 N--CA 1.457 -0.077 0 CA-C-O 120.888 0.375 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.407 ' CG ' ' HB3' ' A' ' 70' ' ' GLN . 14.2 m-85 -60.76 156.27 17.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.83 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.565 ' O ' HG13 ' A' ' 68' ' ' VAL . 9.2 mtm-85 -165.78 175.58 8.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.859 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.582 ' HG3' HG22 ' A' ' 68' ' ' VAL . 14.9 tt0 -159.65 118.78 2.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.918 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.2 p -121.71 -176.88 3.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.852 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.524 ' NE2' HD23 ' A' ' 66' ' ' LEU . 7.3 m-70 -133.84 86.21 2.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.899 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.557 HD23 HD12 ' A' ' 67' ' ' LEU . 4.0 pp -59.11 -33.42 70.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.862 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.462 ' HE3' HD13 ' A' ' 65' ' ' LEU . 6.6 mtmt -111.4 167.31 9.25 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.77 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.29 -12.85 37.32 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.501 2.134 . . . . 0.0 112.482 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -154.7 54.42 0.67 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.727 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.462 HD13 ' HE3' ' A' ' 62' ' ' LYS . 0.2 OUTLIER -151.04 125.69 9.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.908 -179.824 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.77 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -91.87 161.53 14.8 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.612 179.709 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.557 HD12 HD23 ' A' ' 61' ' ' LEU . 5.7 tt -160.5 94.1 1.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.911 0.386 . . . . 0.0 111.112 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.582 HG22 ' HG3' ' A' ' 58' ' ' GLU . 34.7 t -89.96 136.33 24.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.341 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -154.39 154.03 32.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.852 0.358 . . . . 0.0 111.272 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.407 ' HB3' ' CG ' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -133.79 123.01 24.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.783 179.917 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.541 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -88.42 126.81 41.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.784 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.401 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -96.59 99.7 11.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.681 179.702 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.69 -23.05 26.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.204 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 -50.97 -34.63 29.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.909 0.385 . . . . 0.0 111.047 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -143.89 16.82 1.77 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.202 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 m120 47.62 68.74 0.61 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.757 0.313 . . . . 0.0 111.343 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.401 ' HB ' ' CG ' ' A' ' 72' ' ' LYS . 97.9 m -128.32 138.68 52.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.052 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.67 HD12 HD22 ' A' ' 2' ' ' LEU . 1.2 tt -95.74 92.06 6.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.721 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.413 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 3.9 t80 -91.48 118.03 30.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.882 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.662 HD11 HD21 ' A' ' 27' ' ' LEU . 4.8 mt -76.14 179.38 5.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.69 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.406 ' N ' ' O ' ' A' ' 68' ' ' VAL . 90.9 t -150.36 -73.89 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.113 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.504 ' HB2' HG23 ' A' ' 68' ' ' VAL . 9.4 mtp85 -98.03 167.86 10.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.956 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.567 HD12 HD12 ' A' ' 17' ' ' LEU . 0.3 OUTLIER -178.3 90.14 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.876 179.974 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.835 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 176.49 175.74 44.08 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.402 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.9 t -98.01 151.58 20.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.901 0.381 . . . . 0.0 110.842 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -68.04 -47.58 68.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.922 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 29.7 p -60.54 -31.89 70.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.858 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.86 -60.52 2.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.872 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.744 HD21 ' OD1' ' A' ' 13' ' ' ASP . 3.8 mp . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.887 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.536 ' N ' HD23 ' A' ' 2' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.831 0.348 . . . . 0.0 110.891 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -178.52 0.05 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.964 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.407 HD12 ' N ' ' A' ' 4' ' ' ILE . 4.3 mp -127.81 120.93 55.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.132 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -112.56 165.5 12.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.735 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 71.6 p -134.47 149.65 50.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.056 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.416 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 1.4 t -105.43 -172.24 2.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.936 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -75.96 -54.72 6.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.821 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -64.46 -33.17 75.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.799 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.826 ' CZ ' HD13 ' A' ' 80' ' ' LEU . 89.6 t80 -61.93 -30.09 70.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.906 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -68.99 -53.29 21.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.038 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.5 ptmm? -70.84 -10.37 59.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.48 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -85.82 -27.97 24.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.713 0.292 . . . . 0.0 110.946 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 14' ' ' LEU . 3.1 tp -83.44 -34.79 25.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.058 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.9 pttt -59.02 -29.24 67.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.169 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.2 mm -76.08 -39.46 36.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.327 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.674 HD11 ' HA2' ' A' ' 84' ' ' GLY . 10.7 mt -70.76 -44.22 67.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.014 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.1 p -59.76 -28.42 40.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.066 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -78.44 -30.51 47.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.887 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -87.27 -39.8 15.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.966 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 159.56 76.14 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.601 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -147.05 165.84 28.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.808 0.337 . . . . 0.0 110.862 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -125.3 165.98 17.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.963 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.9 mp -90.28 -54.25 4.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.8 mmtt -58.24 -22.96 54.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.1 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.574 ' O ' HG23 ' A' ' 30' ' ' VAL . 3.0 tm? -54.21 -52.74 60.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.033 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.6 -30.65 70.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.96 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -73.24 -26.45 61.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.085 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.23 -33.79 24.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.005 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 26' ' ' LEU . 41.0 t -71.59 -16.82 19.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.447 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.2 t -49.53 -28.33 3.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 120.828 0.347 . . . . 0.0 111.26 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -73.5 -26.72 69.2 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.42 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -90.11 -29.3 18.41 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.758 0.313 . . . . 0.0 110.857 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.3 mt -66.04 -37.92 87.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.904 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.47 -31.61 60.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.111 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 43.4 p -82.51 -44.03 16.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.853 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.639 ' HA ' HD11 ' A' ' 40' ' ' LEU . 16.8 mt-10 61.29 51.9 4.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.945 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -93.55 -53.02 0.25 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.139 -179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -85.12 -88.97 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.513 2.142 . . . . 0.0 112.726 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.639 HD11 ' HA ' ' A' ' 37' ' ' GLU . 0.8 OUTLIER 56.17 28.79 13.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.801 0.334 . . . . 0.0 111.127 180.0 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 61.66 116.44 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.053 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -66.85 -26.27 44.8 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.424 2.083 . . . . 0.0 112.324 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.71 -30.82 71.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.986 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -108.71 -59.51 1.87 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.956 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.4 mttm 63.99 134.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.944 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -66.73 155.15 38.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.954 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 10.9 p-80 -171.48 156.18 4.29 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.897 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo . . . . . 0 C--N 1.344 0.323 0 C-N-CA 122.616 2.211 . . . . 0.0 112.19 179.959 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.82 0.343 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.553 ' HE2' HG11 ' A' ' 81' ' ' VAL . 2.5 m-85 -74.94 141.72 44.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.858 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.3 mtt180 -156.74 152.91 27.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.849 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -131.39 149.5 52.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.025 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.568 ' SG ' HD23 ' A' ' 67' ' ' LEU . 32.1 p -139.54 -173.25 3.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.778 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 75.9 m-70 -138.86 85.04 2.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.948 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.491 HD23 HD22 ' A' ' 67' ' ' LEU . 2.1 pp -64.81 -41.08 96.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.816 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.432 ' HD3' HD22 ' A' ' 65' ' ' LEU . 8.0 mttt -102.65 166.61 11.65 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.833 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.85 -12.28 34.85 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.576 2.184 . . . . 0.0 112.425 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -154.33 52.05 0.66 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.888 0.375 . . . . 0.0 110.614 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.432 HD22 ' HD3' ' A' ' 62' ' ' LYS . 0.7 OUTLIER -152.6 127.78 9.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.955 -179.705 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.783 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -89.92 166.33 13.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.502 179.7 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.568 HD23 ' SG ' ' A' ' 59' ' ' CYS . 43.9 tp -159.46 98.57 1.41 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.967 0.413 . . . . 0.0 111.614 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.444 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 19.9 t -95.08 124.74 47.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.691 178.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.462 ' CD1' ' CD1' ' A' ' 71' ' ' ILE . 7.8 p90 -141.18 163.39 33.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.128 0.49 . . . . 0.0 111.534 -179.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -141.66 107.62 5.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.399 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.566 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -84.88 146.28 6.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.014 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.17 104.72 10.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.693 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -59.96 -21.02 60.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.176 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.1 tp-100 -52.46 -33.6 45.2 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.104 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -144.32 17.19 1.7 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.268 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 47.38 74.79 0.15 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.894 0.378 . . . . 0.0 111.234 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 82.3 m -134.46 148.72 50.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.996 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.479 ' HB2' HD12 ' A' ' 2' ' ' LEU . 1.2 tt -107.67 93.04 4.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.63 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.416 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.7 t80 -89.99 105.74 18.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.991 -179.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.826 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 3.8 mt -65.73 -179.38 0.67 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.521 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.553 HG11 ' HE2' ' A' ' 56' ' ' PHE . 59.9 t -154.81 -59.53 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.24 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.408 ' HB2' ' CG2' ' A' ' 68' ' ' VAL . 0.0 OUTLIER -113.25 165.95 11.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.85 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.497 ' CD2' HD13 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -177.84 99.16 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.963 -179.944 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.783 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 165.29 -161.39 34.8 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.39 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.2 p -123.03 155.51 36.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.751 0.31 . . . . 0.0 110.976 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -69.17 -31.53 70.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.97 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.1 t -74.78 -34.98 62.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.945 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.93 -57.2 4.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.898 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.971 179.916 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.572 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.035 0 CA-C-O 120.822 0.344 . . . . 0.0 110.844 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.665 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -80.26 -173.61 4.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.882 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.4 mp -139.9 112.98 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.99 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -112.41 162.45 15.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.749 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.622 HG22 HD12 ' A' ' 80' ' ' LEU . 74.4 p -141.95 143.3 33.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.074 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.27 175.28 9.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.968 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.5 mtmt -64.79 -45.74 85.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.836 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -61.14 -21.71 64.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.092 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CZ ' ' HB2' ' A' ' 83' ' ' LEU . 1.0 OUTLIER -65.31 -32.45 74.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.004 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.12 -44.43 79.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.935 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.23 -8.85 59.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.371 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.14 -27.27 19.72 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.669 0.271 . . . . 0.0 111.257 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.9 -41.71 11.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.462 -179.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.6 pttm -54.67 -24.31 21.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.345 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.2 mm -83.43 -32.16 8.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.108 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.526 HD13 HD21 ' A' ' 65' ' ' LEU . 91.2 mt -82.03 -38.05 25.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.051 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.0 p -59.27 -30.48 44.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.115 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.31 -45.89 24.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.819 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -71.66 -31.6 67.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.82 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 149.56 75.98 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.543 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.718 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 8.2 t80 -153.7 165.46 35.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.876 0.369 . . . . 0.0 110.907 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -145.51 164.5 31.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.821 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.6 mp -94.77 -29.04 14.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.948 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -33.35 69.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.919 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.718 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 4.4 pp -74.1 -30.66 62.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.021 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.468 ' HA ' HG12 ' A' ' 30' ' ' VAL . 7.3 tt -73.78 -25.99 60.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.137 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.607 ' O ' HG22 ' A' ' 31' ' ' VAL . 0.7 OUTLIER -81.01 -28.58 35.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.094 -179.936 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.73 -36.11 17.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.042 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.468 HG12 ' HA ' ' A' ' 27' ' ' LEU . 13.1 p -62.6 -21.12 26.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.392 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.607 HG22 ' O ' ' A' ' 28' ' ' TYR . 27.8 m -47.68 -32.56 2.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.834 0.349 . . . . 0.0 111.462 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.83 -26.52 74.29 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.474 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -89.88 -27.38 19.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.744 0.307 . . . . 0.0 110.967 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 69.2 mt -66.49 -43.93 84.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.015 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.03 -37.43 72.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.276 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 53.3 p -78.7 -41.44 31.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.021 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.817 ' HA ' HD21 ' A' ' 40' ' ' LEU . 9.2 mt-10 62.08 49.95 4.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.87 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.552 ' H ' ' HD2' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -98.76 -61.76 0.11 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.641 -179.827 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.552 ' HD2' ' H ' ' A' ' 38' ' ' GLN . 30.1 Cg_endo -63.66 -85.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.274 1.983 . . . . 0.0 112.958 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.817 HD21 ' HA ' ' A' ' 37' ' ' GLU . 1.1 mm? 47.61 -173.1 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.801 0.334 . . . . 0.0 111.376 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.404 ' HB1' ' HE2' ' A' ' 43' ' ' LYS . . . -105.25 145.64 31.16 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.12 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.408 ' HA ' ' HD2' ' A' ' 45' ' ' LYS . 73.5 Cg_endo -75.72 -28.92 7.62 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.618 2.212 . . . . 0.0 112.352 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.404 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 2.9 pttt -76.71 -27.28 55.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.044 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.501 ' CD2' ' CG ' ' A' ' 60' ' ' HIS . 19.8 m-85 -105.29 -54.6 2.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.926 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HD2' ' HA ' ' A' ' 42' ' ' PRO . 0.0 OUTLIER 62.92 147.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.803 -179.896 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -87.19 134.53 33.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.976 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.416 ' CG ' ' HD2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -173.22 162.44 3.48 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.857 179.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.416 ' HD2' ' CG ' ' A' ' 47' ' ' HIS . 44.0 Cg_endo . . . . . 0 C--N 1.345 0.355 0 C-N-CA 122.583 2.189 . . . . 0.0 112.264 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 . . . . . 0 C--O 1.23 0.046 0 CA-C-O 120.843 0.354 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.422 ' CE2' HG21 ' A' ' 81' ' ' VAL . 7.8 m-85 -89.89 137.42 32.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.844 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.3 mtt180 -154.34 148.64 26.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.862 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.437 ' HG3' HG22 ' A' ' 68' ' ' VAL . 30.9 tt0 -118.2 150.04 40.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.04 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 30.4 p -148.47 151.41 35.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.857 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.501 ' CG ' ' CD2' ' A' ' 44' ' ' TYR . 17.2 m-70 -107.83 92.42 4.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.899 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.754 HD12 ' HB2' ' A' ' 62' ' ' LYS . 4.3 pp -68.04 -30.87 70.19 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.782 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.754 ' HB2' HD12 ' A' ' 61' ' ' LEU . 33.2 tptt -140.24 139.55 21.23 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.61 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_exo -43.44 132.96 7.07 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.565 2.177 . . . . 0.0 112.419 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 65.87 25.58 11.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.799 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.526 HD21 HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -145.81 120.0 9.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.712 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.478 HD11 ' HA ' ' A' ' 85' ' ' SER . 0.0 OUTLIER -101.43 -178.25 3.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.679 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.521 ' HG ' HD23 ' A' ' 83' ' ' LEU . 6.8 tt -167.92 103.55 0.48 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.071 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.437 HG22 ' HG3' ' A' ' 58' ' ' GLU . 24.8 t -94.88 138.98 19.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.543 179.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.754 ' HA ' HG23 ' A' ' 81' ' ' VAL . 6.1 p90 -147.85 161.95 40.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 0.0 111.31 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -128.52 120.24 26.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.438 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.518 ' N ' HD13 ' A' ' 71' ' ' ILE . 3.0 mm -84.71 141.51 14.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.38 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.427 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -127.45 87.5 2.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.695 179.806 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -56.39 -22.53 32.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.248 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -50.11 -32.82 16.83 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.891 0.377 . . . . 0.0 111.118 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -142.9 16.6 1.95 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.179 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 47.43 68.3 0.67 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.843 0.354 . . . . 0.0 111.22 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.665 HG23 ' HB ' ' A' ' 3' ' ' THR . 88.7 m -133.41 136.29 45.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.911 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.572 ' HB2' HD12 ' A' ' 2' ' ' LEU . 34.3 tp -95.06 92.37 6.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.727 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -90.08 115.74 27.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.966 -179.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.622 HD12 HG22 ' A' ' 6' ' ' THR . 30.6 mt -73.27 171.52 12.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.742 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.754 HG23 ' HA ' ' A' ' 69' ' ' TYR . 57.9 t -133.51 -70.22 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.291 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -118.45 175.78 5.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.117 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.521 HD23 ' HG ' ' A' ' 67' ' ' LEU . 0.4 OUTLIER -173.47 90.96 0.08 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.849 -179.983 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.62 127.92 1.49 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.749 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.478 ' HA ' HD11 ' A' ' 66' ' ' LEU . 0.6 OUTLIER -54.33 154.91 4.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.829 0.347 . . . . 0.0 111.127 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.84 -33.59 75.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.897 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.36 -32.35 60.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.875 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -67.18 -48.06 69.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.912 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.823 179.985 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.823 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.828 0.347 . . . . 0.0 110.808 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.467 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -57.96 -176.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.015 -179.806 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.51 HG12 HG21 ' A' ' 31' ' ' VAL . 4.3 mp -136.36 115.26 15.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.994 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -108.64 159.68 16.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.813 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 39.9 p -139.19 150.05 45.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.926 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.4 ' HB2' ' CZ ' ' A' ' 79' ' ' PHE . 0.1 OUTLIER -118.19 -168.83 1.59 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.944 179.975 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -78.07 -46.08 21.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.898 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -61.47 -33.79 74.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.771 ' CZ ' HD11 ' A' ' 14' ' ' LEU . 13.2 t80 -69.88 -37.68 76.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -72.94 -29.52 63.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.978 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -76.22 -23.19 54.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.153 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.456 ' OD1' HD11 ' A' ' 89' ' ' LEU . 0.4 OUTLIER -84.37 -46.79 11.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.069 -179.817 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.771 HD11 ' CZ ' ' A' ' 10' ' ' PHE . 81.0 mt -59.79 -37.46 79.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.096 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt -56.95 -26.83 60.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.141 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.9 mm -82.45 -33.65 11.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.172 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.3 mt -79.99 -41.3 26.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.033 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.6 p -57.84 -29.55 35.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.157 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.2 tttt -81.21 -31.22 34.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.93 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -100.43 30.39 3.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.971 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.11 95.3 0.81 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.592 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.686 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 11.4 t80 -176.6 113.39 0.1 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.814 0.34 . . . . 0.0 110.831 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.499 ' HB2' HD23 ' A' ' 26' ' ' LEU . 5.0 m-20 -74.85 160.39 30.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.956 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.82 -28.2 14.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.993 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.9 mtmm -69.23 -29.6 67.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.957 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.686 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 4.4 pp -58.6 -30.97 67.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.953 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.64 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -75.99 -23.91 55.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.159 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -82.44 -30.55 29.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.785 0.326 . . . . 0.0 111.003 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -88.31 -33.46 18.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.031 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.546 HG22 ' HG ' ' A' ' 34' ' ' LEU . 10.8 p -62.74 -21.52 27.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.321 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.51 HG21 HG12 ' A' ' 4' ' ' ILE . 36.1 t -47.5 -38.33 5.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.293 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.422 ' O ' HG23 ' A' ' 36' ' ' THR . . . -64.27 -32.57 84.64 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.387 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -89.99 -23.19 21.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.748 0.309 . . . . 0.0 111.173 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.546 ' HG ' HG22 ' A' ' 30' ' ' VAL . 52.3 mt -69.77 -40.44 76.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.054 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.414 ' HB2' HD11 ' A' ' 2' ' ' LEU . . . -72.8 -36.6 67.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.276 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.422 HG23 ' O ' ' A' ' 32' ' ' GLY . 25.7 p -83.32 -42.5 17.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.93 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.448 ' HA ' HD11 ' A' ' 40' ' ' LEU . 13.3 mt-10 61.04 58.67 2.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.857 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.406 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 0.5 OUTLIER -88.71 -51.74 0.38 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.517 -179.65 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.406 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 63.1 Cg_endo -77.82 -91.29 0.0 OUTLIER 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 122.174 1.916 . . . . 0.0 112.696 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.57 HD21 ' HB2' ' A' ' 59' ' ' CYS . 3.1 mp 56.51 -178.85 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.801 0.334 . . . . 0.0 111.038 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -94.78 142.15 24.3 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.0 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -74.73 -24.47 13.39 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.553 2.169 . . . . 0.0 112.47 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.54 -29.23 26.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.093 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -95.36 -62.11 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.109 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 mmtt 62.33 149.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.847 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.422 ' HB2' ' CD2' ' A' ' 40' ' ' LEU . 40.8 t0 -93.72 142.5 27.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.997 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.5 p-80 -154.85 142.29 13.85 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.76 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo . . . . . 0 C--N 1.344 0.312 0 C-N-CA 122.482 2.121 . . . . 0.0 112.405 -179.863 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.839 0.352 . . . . 0.0 110.947 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -62.3 139.49 58.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.857 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 56.1 mtm180 -154.65 135.45 13.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.847 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -110.39 119.18 38.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.849 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.57 ' HB2' HD21 ' A' ' 40' ' ' LEU . 24.7 p -127.0 144.61 50.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.781 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -108.06 83.17 1.75 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.028 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 pp -59.04 -32.41 69.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.671 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.651 ' HB2' HD12 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -113.62 170.06 5.77 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.679 179.815 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.425 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 55.1 Cg_endo -70.1 -8.38 23.47 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.384 2.056 . . . . 0.0 112.781 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -151.43 40.69 0.69 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.739 0.304 . . . . 0.0 111.137 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.651 HD12 ' HB2' ' A' ' 62' ' ' LYS . 27.4 mt -131.59 133.7 45.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.052 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.653 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -113.96 116.16 28.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.716 179.739 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.722 ' HG ' HD12 ' A' ' 83' ' ' LEU . 0.4 OUTLIER -113.97 94.62 4.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.998 0.428 . . . . 0.0 111.143 -179.832 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.541 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 26.2 t -96.84 69.87 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.841 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.618 ' HD2' HD22 ' A' ' 67' ' ' LEU . 3.1 p90 -89.51 177.14 6.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.098 0.475 . . . . 0.0 111.345 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -146.15 122.51 10.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.709 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.547 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -92.65 138.17 20.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.852 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.09 102.5 11.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.658 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.63 -20.5 56.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.263 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -52.88 -29.42 28.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.734 0.302 . . . . 0.0 111.081 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -149.23 19.13 0.96 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.277 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 34.8 m120 46.46 74.77 0.14 Allowed 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.731 0.3 . . . . 0.0 111.303 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.467 HG23 ' HB ' ' A' ' 3' ' ' THR . 53.9 m -133.81 147.45 51.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.165 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.823 ' HB2' HD12 ' A' ' 2' ' ' LEU . 0.9 OUTLIER -107.4 95.59 5.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.553 179.596 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CZ ' ' HB2' ' A' ' 7' ' ' SER . 5.4 t80 -89.9 111.65 22.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.866 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.516 HD12 HD21 ' A' ' 67' ' ' LEU . 3.1 mm? -68.23 168.96 11.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.607 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.541 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 98.3 t -152.02 -84.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.432 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 11.1 mtm-85 -96.23 160.44 14.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.865 0.364 . . . . 0.0 111.254 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.722 HD12 ' HG ' ' A' ' 67' ' ' LEU . 0.3 OUTLIER -179.64 114.22 0.05 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.612 179.816 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.653 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 145.55 -159.93 28.0 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.42 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.414 ' O ' HD12 ' A' ' 89' ' ' LEU . 0.3 OUTLIER -121.22 141.05 51.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.809 0.338 . . . . 0.0 110.828 179.854 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -58.95 -30.35 67.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.914 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.1 m -78.23 -32.68 49.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.922 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -70.0 -46.88 64.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.958 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.456 HD11 ' OD1' ' A' ' 13' ' ' ASP . 4.0 mp . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.92 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.804 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.901 0.382 . . . . 0.0 110.922 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.648 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -65.51 -175.57 0.27 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.841 -179.994 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.557 HG12 HG11 ' A' ' 31' ' ' VAL . 4.2 mp -133.37 116.19 24.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.108 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -110.19 168.18 9.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.81 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.431 HG22 ' CE2' ' A' ' 10' ' ' PHE . 77.6 p -138.41 147.93 43.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.894 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.404 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 2.6 t -105.71 -168.19 1.42 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.886 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -74.53 -58.18 3.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.966 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -58.88 -34.56 71.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.964 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.593 ' HZ ' HD21 ' A' ' 27' ' ' LEU . 10.7 t80 -60.29 -34.86 74.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.927 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.32 -35.02 63.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.862 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.7 mtpp -82.11 -20.96 37.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.087 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.566 ' CG ' HD21 ' A' ' 89' ' ' LEU . 2.0 m-20 -84.1 -28.44 27.52 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.139 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -83.8 -36.49 23.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.161 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 12.6 pttp -58.6 -29.98 66.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.055 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.4 mm -83.62 -33.24 9.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.118 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.564 HD11 ' CA ' ' A' ' 84' ' ' GLY . 18.1 mt -73.68 -43.14 60.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.912 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.2 p -60.24 -30.93 47.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.11 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -72.92 -33.74 66.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.804 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -84.97 -48.74 8.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.927 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 163.3 76.95 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.501 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.867 ' CE1' HD11 ' A' ' 26' ' ' LEU . 56.4 t80 -153.07 116.8 4.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.858 0.361 . . . . 0.0 110.908 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.47 156.13 24.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.866 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.3 mp -91.36 -29.93 16.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.913 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -58.81 -36.87 75.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.97 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.867 HD11 ' CE1' ' A' ' 22' ' ' PHE . 3.9 pp -66.35 -30.67 71.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.885 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.593 HD21 ' HZ ' ' A' ' 10' ' ' PHE . 9.1 tp -71.71 -29.07 64.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.983 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.515 ' O ' HG22 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -83.21 -25.22 31.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.956 179.936 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 mttt -88.04 -34.45 17.99 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.075 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.4 p -60.28 -19.63 18.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.331 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.557 HG11 HG12 ' A' ' 4' ' ' ILE . 29.4 m -48.7 -41.06 12.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.827 0.346 . . . . 0.0 111.362 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.414 ' N ' HG23 ' A' ' 31' ' ' VAL . . . -60.66 -27.5 66.42 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.371 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -89.29 -30.01 18.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 0.0 110.871 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.3 mt -63.38 -38.07 89.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.873 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.93 -51.97 14.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.079 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.5 p -66.35 -44.54 82.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.917 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.749 ' HA ' HD11 ' A' ' 40' ' ' LEU . 33.6 mt-10 60.42 51.92 5.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.891 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.4 ' N ' ' CD ' ' A' ' 39' ' ' PRO . 0.5 OUTLIER -91.31 -52.12 0.3 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.233 -179.841 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.4 ' CD ' ' N ' ' A' ' 38' ' ' GLN . 74.3 Cg_endo -84.18 -92.13 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.406 2.071 . . . . 0.0 112.684 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.749 HD11 ' HA ' ' A' ' 37' ' ' GLU . 0.6 OUTLIER 54.55 36.78 26.63 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-O 120.849 0.357 . . . . 0.0 111.143 -179.967 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.54 127.95 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.08 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -77.27 -3.4 13.65 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.482 2.121 . . . . 0.0 112.832 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -102.63 -32.38 9.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 0.0 111.023 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -95.25 -52.68 4.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.904 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.2 mmtt 62.69 148.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.794 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.538 ' CB ' HD13 ' A' ' 40' ' ' LEU . 59.5 t0 -91.51 139.56 30.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.949 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 11.8 p-80 -158.42 146.42 13.78 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.79 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo . . . . . 0 C--N 1.346 0.398 0 C-N-CA 122.532 2.155 . . . . 0.0 112.337 179.979 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.768 0.318 . . . . 0.0 111.029 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.413 ' HE1' HG21 ' A' ' 81' ' ' VAL . 9.9 m-85 -78.02 143.98 37.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.832 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -156.4 142.8 18.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.595 -179.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.413 ' CG ' HG22 ' A' ' 68' ' ' VAL . 24.1 tt0 -128.5 148.89 50.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.124 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 32.1 p -137.15 -172.46 3.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.631 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 28.3 m-70 -143.73 85.84 1.85 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.981 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.701 ' CD2' HD12 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -61.01 -43.43 98.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.75 179.843 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.504 ' HD2' HD12 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -99.51 166.36 13.03 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.859 179.827 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.39 -3.53 14.02 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.749 2.299 . . . . 0.0 112.972 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -147.59 33.83 0.86 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.609 0.242 . . . . 0.0 111.08 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 mp -151.84 145.59 25.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.903 0.382 . . . . 0.0 111.098 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -110.53 -173.19 2.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.293 179.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.87 HD21 ' CD1' ' A' ' 80' ' ' LEU . 4.1 tt -169.99 103.58 0.31 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.876 0.37 . . . . 0.0 111.431 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.413 HG22 ' CG ' ' A' ' 58' ' ' GLU . 13.7 t -94.66 120.95 44.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.09 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.672 ' HD2' HD22 ' A' ' 67' ' ' LEU . 6.3 p90 -137.78 159.54 41.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.004 0.431 . . . . 0.0 111.433 -179.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -132.42 122.74 25.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.505 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.529 ' N ' HD13 ' A' ' 71' ' ' ILE . 3.0 mm -84.74 131.04 34.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.41 -179.568 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.431 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -111.82 85.02 2.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.665 179.757 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.0 mttt -56.19 -23.02 32.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.264 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -51.97 -30.38 24.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.845 0.355 . . . . 0.0 111.047 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -142.25 16.47 2.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.311 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 47.05 69.31 0.51 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.858 0.361 . . . . 0.0 111.311 179.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.648 HG23 ' HB ' ' A' ' 3' ' ' THR . 49.3 m -139.13 143.67 38.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.067 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.804 ' HB2' HD12 ' A' ' 2' ' ' LEU . 0.6 OUTLIER -97.29 96.45 8.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.668 179.722 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.408 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 3.7 t80 -94.39 114.19 26.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.945 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.87 ' CD1' HD21 ' A' ' 67' ' ' LEU . 3.0 mm? -69.62 169.86 11.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.797 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.574 HG23 ' HA ' ' A' ' 69' ' ' TYR . 35.1 t -136.41 -63.66 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.069 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.8 ttt85 -133.07 172.52 12.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.914 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.736 HD12 ' HG ' ' A' ' 67' ' ' LEU . 1.9 tt -176.84 146.53 0.55 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.949 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.564 ' CA ' HD11 ' A' ' 17' ' ' LEU . . . 99.94 129.52 6.64 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.488 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -52.68 138.93 27.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.84 0.352 . . . . 0.0 111.09 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -30.12 66.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.936 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.9 p -64.65 -32.96 74.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -73.73 -44.81 55.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.91 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.566 HD21 ' CG ' ' A' ' 13' ' ' ASP . 5.0 mp . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.1 mt . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.763 0.316 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.691 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -69.39 -177.32 1.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.862 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.512 HG12 HG11 ' A' ' 31' ' ' VAL . 3.8 mp -133.8 116.91 24.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.196 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -110.49 159.81 17.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.712 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 34.2 p -130.93 149.85 52.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.115 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.9 t -106.13 -166.8 1.23 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.8 mtmm -82.85 -52.09 7.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.027 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.4 mmtp -70.24 -31.77 69.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.027 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.633 ' CE1' HD11 ' A' ' 14' ' ' LEU . 76.4 t80 -59.95 -53.66 55.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.884 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.29 -31.03 68.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.988 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -82.35 -20.03 38.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.179 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.515 ' O ' HD23 ' A' ' 17' ' ' LEU . 2.7 m-20 -85.37 -28.36 25.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.19 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.669 ' O ' HG23 ' A' ' 18' ' ' VAL . 3.9 mp -81.59 -37.65 27.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.162 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.1 ptpt -58.27 -29.77 66.07 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.089 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.1 mm -81.05 -43.81 20.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.069 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.574 ' CD1' HD21 ' A' ' 65' ' ' LEU . 2.1 mm? -56.62 -26.84 56.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.924 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.669 HG23 ' O ' ' A' ' 14' ' ' LEU . 20.6 t -57.41 -54.59 28.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.126 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.1 tptm -59.18 -28.67 66.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.08 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -97.84 33.57 2.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.973 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.79 88.35 0.38 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.486 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.456 ' CE1' HD11 ' A' ' 26' ' ' LEU . 7.4 t80 -176.56 166.84 2.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.74 0.305 . . . . 0.0 110.838 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -157.01 158.99 37.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.912 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -88.39 -29.68 20.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.003 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -63.58 -45.2 91.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.906 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.742 HD12 ' N ' ' A' ' 27' ' ' LEU . 4.3 pp -60.1 -31.63 70.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.921 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.742 ' N ' HD12 ' A' ' 26' ' ' LEU . 3.7 tt -76.26 -28.7 57.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.913 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.641 ' O ' HG22 ' A' ' 31' ' ' VAL . 0.2 OUTLIER -59.11 -29.49 67.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.907 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.61 -30.85 18.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.055 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.694 HG23 ' O ' ' A' ' 26' ' ' LEU . 34.6 t -64.38 -22.49 31.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.247 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 28' ' ' TYR . 29.1 m -50.35 -29.29 6.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.226 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -70.0 -33.74 70.24 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.397 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -86.32 -28.93 23.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.739 0.304 . . . . 0.0 110.881 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.547 ' HG ' HG12 ' A' ' 30' ' ' VAL . 90.0 mt -63.25 -38.31 90.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.831 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.24 -34.9 61.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.185 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 51.4 p -78.86 -41.35 30.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.837 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.409 ' HA ' HD21 ' A' ' 40' ' ' LEU . 26.8 mt-10 58.07 61.39 2.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.972 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.435 ' CB ' ' HD3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -102.48 -55.18 0.12 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.411 -179.79 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.435 ' HD3' ' CB ' ' A' ' 38' ' ' GLN . 41.7 Cg_endo -86.04 -76.36 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.379 2.053 . . . . 0.0 112.338 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.693 HD12 ' HB3' ' A' ' 59' ' ' CYS . 2.5 mm? 48.65 27.65 1.57 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.814 0.34 . . . . 0.0 111.433 179.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 62.11 121.01 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.116 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.95 -35.78 90.54 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.425 2.084 . . . . 0.0 112.388 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.73 -30.45 68.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.852 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -109.63 63.86 0.61 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.857 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.7 mttp -60.29 102.5 0.18 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.815 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -51.56 145.33 9.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.087 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -168.28 162.97 8.82 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.914 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo . . . . . 0 C--N 1.343 0.253 0 C-N-CA 122.605 2.204 . . . . 0.0 112.353 -179.93 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.742 0.306 . . . . 0.0 111.182 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -94.0 125.35 38.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.882 0.372 . . . . 0.0 110.908 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -145.07 155.26 43.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.783 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.41 ' HG3' HG22 ' A' ' 68' ' ' VAL . 29.7 tt0 -121.66 154.57 36.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.003 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.693 ' HB3' HD12 ' A' ' 40' ' ' LEU . 7.3 m -145.76 -169.99 3.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.895 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -139.03 110.8 7.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.898 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 1.056 HD23 HD12 ' A' ' 67' ' ' LEU . 3.7 pp -83.17 -38.26 22.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.85 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.42 ' CB ' ' HD2' ' A' ' 63' ' ' PRO . 2.7 mttm -108.13 169.36 6.69 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.788 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.42 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 47.5 Cg_endo -68.8 -9.39 26.1 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.466 2.11 . . . . 0.0 112.823 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -150.63 49.43 0.87 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.85 0.357 . . . . 0.0 110.941 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.574 HD21 ' CD1' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -159.31 140.66 12.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.113 180.0 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.62 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -101.53 -177.69 3.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.339 179.589 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 1.056 HD12 HD23 ' A' ' 61' ' ' LEU . 3.0 tt -170.02 102.64 0.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.821 0.343 . . . . 0.0 111.493 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.41 HG22 ' HG3' ' A' ' 58' ' ' GLU . 23.4 t -90.04 125.44 42.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.124 178.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.476 ' HD2' HD22 ' A' ' 67' ' ' LEU . 10.0 p90 -145.06 163.36 34.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.864 0.364 . . . . 0.0 111.422 -179.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.35 119.3 9.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.754 179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.564 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -85.07 146.32 6.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.9 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.52 103.7 10.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.88 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.3 mmtp -56.72 -21.93 31.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.212 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -47.44 -36.6 10.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.804 0.335 . . . . 0.0 111.312 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -148.36 20.99 1.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.194 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 48.96 73.59 0.22 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.853 0.359 . . . . 0.0 111.059 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.691 HG23 ' HB ' ' A' ' 3' ' ' THR . 99.8 m -132.45 147.4 52.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.915 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.01 91.81 3.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.732 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.42 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 4.3 t80 -89.94 121.11 31.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.833 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.994 HD12 HD21 ' A' ' 67' ' ' LEU . 3.0 mm? -76.76 176.08 8.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.74 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.439 HG23 ' HA ' ' A' ' 69' ' ' TYR . 60.5 t -145.35 -66.34 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.144 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 -123.39 169.07 11.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.962 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.4 HD13 HD11 ' A' ' 14' ' ' LEU . 8.7 tt -176.11 134.66 0.26 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.901 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.62 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 143.86 -141.43 10.28 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.591 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.3 m -134.61 175.62 9.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.907 0.385 . . . . 0.0 110.883 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -82.08 -32.58 30.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.4 m -78.65 -32.9 47.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.95 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.38 -58.77 3.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.905 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.83 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.413 HD23 ' OD1' ' A' ' 76' ' ' ASN . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.854 0.359 . . . . 0.0 110.912 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.643 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -68.36 -174.9 0.57 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.824 179.977 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -133.98 120.99 37.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.121 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -115.02 163.84 15.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.737 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.5 p -128.28 155.44 44.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.041 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 14.7 m -99.99 -178.37 3.83 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.984 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -74.16 -46.23 43.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.826 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -29.65 69.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.02 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.441 ' CE2' ' HB3' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -58.28 -38.98 78.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.997 179.975 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -61.86 -33.12 73.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.78 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -89.95 -21.63 22.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.139 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.443 ' OD1' HD21 ' A' ' 89' ' ' LEU . 86.7 m-20 -79.59 -25.94 41.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.155 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.1 mp -88.86 -38.44 14.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.26 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 48.6 pttt -57.86 -30.33 65.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.133 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.9 mm -85.19 -29.15 6.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.161 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.771 HD11 ' HA2' ' A' ' 84' ' ' GLY . 18.0 mt -81.22 -36.82 29.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.916 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.6 p -60.14 -26.21 35.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.111 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -90.09 -42.98 10.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.545 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.09 -30.88 69.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.534 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 147.87 80.35 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.41 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.937 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 8.9 t80 -157.57 171.88 19.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.941 0.401 . . . . 0.0 110.942 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -145.51 169.42 18.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.862 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.7 mp -97.67 -27.75 14.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.08 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -66.34 -34.18 77.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.952 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.937 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 3.9 pp -64.79 -34.34 78.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.892 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.568 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.6 OUTLIER -75.41 -41.25 56.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.883 179.965 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -72.42 -23.67 61.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.2 mmmt -90.04 -31.68 17.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.333 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.553 HG12 ' HA ' ' A' ' 27' ' ' LEU . 12.7 p -80.8 -7.4 10.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.865 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 27' ' ' LEU . 43.5 t -53.94 -42.02 51.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-O 120.778 0.323 . . . . 0.0 111.125 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.81 -27.0 72.33 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.379 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -87.2 -19.41 28.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.589 0.233 . . . . 0.0 111.159 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.5 mt -77.95 -38.29 45.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.918 0.389 . . . . 0.0 110.983 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.81 -33.03 73.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.244 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 71.2 p -97.87 -31.49 12.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 60.86 58.94 2.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.874 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.475 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -75.35 -56.98 1.77 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.44 -179.876 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 25.0 Cg_endo -62.23 -82.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.063 1.842 . . . . 0.0 112.468 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.418 HD22 ' N ' ' A' ' 40' ' ' LEU . 3.0 mm? 46.56 97.36 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.121 0 CA-C-O 120.873 0.368 . . . . 0.0 111.549 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.37 146.86 4.38 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.371 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.16 -25.35 19.14 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.564 2.176 . . . . 0.0 112.461 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.3 -28.12 61.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.166 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.412 ' HB3' ' CD2' ' A' ' 60' ' ' HIS . 58.9 m-85 -112.46 -66.79 1.05 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.156 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.3 tttt 63.06 149.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.867 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -76.33 121.46 23.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.841 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -149.22 163.97 23.03 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.899 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo . . . . . 0 C--N 1.343 0.281 0 C-N-CA 122.532 2.154 . . . . 0.0 112.208 179.898 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.802 0.334 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -108.4 145.3 34.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.884 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -159.02 128.4 5.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.747 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.638 ' HB2' HG22 ' A' ' 68' ' ' VAL . 0.8 OUTLIER -105.88 136.28 45.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.0 -179.8 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 32.0 p -129.2 149.61 50.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.682 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.412 ' CD2' ' HB3' ' A' ' 44' ' ' TYR . 34.3 m-70 -107.12 86.05 2.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.142 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.509 HD12 ' N ' ' A' ' 62' ' ' LYS . 3.7 pp -59.22 -41.1 87.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.692 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.509 ' N ' HD12 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -111.98 167.67 8.79 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.748 179.738 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.8 -7.59 21.7 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.464 2.109 . . . . 0.0 112.943 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -148.32 42.37 1.0 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.762 0.315 . . . . 0.0 111.161 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 89.7 mt -154.33 135.63 14.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.906 0.384 . . . . 0.0 111.059 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.665 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -102.46 171.71 7.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.448 179.7 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.488 HD23 ' C ' ' A' ' 67' ' ' LEU . 5.6 tt -165.46 100.3 0.71 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.945 0.402 . . . . 0.0 111.356 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.638 HG22 ' HB2' ' A' ' 58' ' ' GLU . 33.6 t -96.18 135.44 30.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.034 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.689 ' HA ' HG23 ' A' ' 81' ' ' VAL . 5.8 p90 -146.0 161.98 38.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.995 0.426 . . . . 0.0 111.35 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -131.47 124.95 31.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.516 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.528 ' N ' HD13 ' A' ' 71' ' ' ILE . 2.9 mm -84.6 143.85 10.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.344 -179.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.415 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -127.85 87.72 2.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.714 179.848 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.7 pttt -57.69 -22.21 44.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.217 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -51.7 -32.21 29.12 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.847 0.356 . . . . 0.0 110.987 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -141.27 15.22 2.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.219 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.413 ' OD1' HD23 ' A' ' 2' ' ' LEU . 2.0 t30 47.54 69.91 0.47 Allowed 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 120.84 0.352 . . . . 0.0 111.156 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.643 HG23 ' HB ' ' A' ' 3' ' ' THR . 76.3 m -137.44 146.12 43.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.986 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 34.1 tp -101.0 92.33 4.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.776 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -90.77 114.02 26.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.86 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.441 ' HB3' ' CE2' ' A' ' 10' ' ' PHE . 2.6 mt -71.48 178.96 3.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.928 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.689 HG23 ' HA ' ' A' ' 69' ' ' TYR . 58.7 t -139.13 -70.85 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.105 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -129.99 171.49 12.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.975 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.7 tt -174.9 152.66 1.56 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.872 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.771 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 125.6 -156.99 19.56 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.467 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.3 t -119.99 133.93 55.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.933 0.397 . . . . 0.0 110.885 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -59.76 -47.73 84.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.972 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 25.1 p -64.56 -31.11 72.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.997 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -73.89 -56.51 4.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.443 HD21 ' OD1' ' A' ' 13' ' ' ASP . 3.3 mp . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.981 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.79 0.329 . . . . 0.0 110.85 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.42 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -60.66 -177.4 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.908 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -128.7 106.28 14.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.12 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -103.07 160.97 14.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.803 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.7 p -139.18 151.47 46.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.026 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 16.7 p -109.3 -168.57 1.35 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.821 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.0 -60.01 2.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.924 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.3 mttt -59.91 -33.36 71.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.906 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.442 ' CE1' ' HB3' ' A' ' 80' ' ' LEU . 75.1 t80 -59.46 -53.5 57.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.935 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.34 -29.96 69.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.028 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -83.47 -6.92 59.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.456 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.557 ' OD1' HD21 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -89.99 -29.76 18.23 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.689 0.281 . . . . 0.0 111.061 -179.816 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 pp -84.46 -38.39 20.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.071 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -59.19 -22.15 60.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.228 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.0 mm -88.98 -29.29 5.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.309 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.833 HD11 ' HA2' ' A' ' 84' ' ' GLY . 11.9 mt -79.79 -32.71 40.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.119 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.5 p -61.97 -30.83 49.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.141 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.65 -37.44 35.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.939 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -77.85 -31.33 51.44 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.869 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 145.58 80.17 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.526 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -153.48 161.16 42.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.831 0.348 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -107.96 172.58 6.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.905 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.582 ' N ' HD12 ' A' ' 24' ' ' LEU . 5.5 mp -99.47 -57.85 2.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.975 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -60.82 -21.5 63.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.053 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.904 ' O ' HG23 ' A' ' 30' ' ' VAL . 1.9 tm? -52.73 -54.07 38.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.881 0.372 . . . . 0.0 111.044 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 tt -61.02 -46.32 91.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.827 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.681 ' O ' HG22 ' A' ' 31' ' ' VAL . 4.8 m-85 -60.65 -25.09 66.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.998 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.68 -29.43 22.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.001 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 26' ' ' LEU . 25.6 t -67.76 -24.55 30.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.309 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.681 HG22 ' O ' ' A' ' 28' ' ' TYR . 32.1 m -48.02 -38.95 8.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.852 0.358 . . . . 0.0 111.38 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.23 -27.9 65.98 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.456 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -90.12 -22.45 21.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.662 0.268 . . . . 0.0 111.15 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.3 mt -69.33 -33.08 72.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.833 0.349 . . . . 0.0 110.93 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.75 -32.96 60.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.136 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.0 p -88.67 -46.24 9.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.667 ' C ' HD11 ' A' ' 40' ' ' LEU . 56.5 mt-10 62.03 55.61 2.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.861 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -93.86 -53.19 0.25 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.225 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -84.63 -88.89 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.49 2.126 . . . . 0.0 112.588 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.667 HD11 ' C ' ' A' ' 37' ' ' GLU . 0.4 OUTLIER 55.57 35.88 26.06 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.889 0.376 . . . . 0.0 111.134 179.934 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.585 ' HB1' ' HE2' ' A' ' 43' ' ' LYS . . . 60.14 109.4 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.069 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.82 -25.98 38.85 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.365 2.044 . . . . 0.0 112.414 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.585 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 3.3 pttt -66.78 -31.12 71.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.006 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -103.74 -39.3 6.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.933 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.5 mttm 63.61 127.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.879 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -61.39 146.57 47.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.017 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -160.13 150.7 15.38 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.826 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.41 ' HA ' ' HA ' ' A' ' 57' ' ' ARG . 17.9 Cg_endo . . . . . 0 C--N 1.344 0.327 0 C-N-CA 122.5 2.133 . . . . 0.0 112.36 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.949 0.404 . . . . 0.0 110.759 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -105.31 118.2 35.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.758 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.41 ' HA ' ' HA ' ' A' ' 48' ' ' PRO . 23.4 mtp180 -142.63 155.07 44.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.018 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.542 ' HB2' HG22 ' A' ' 68' ' ' VAL . 0.4 OUTLIER -129.79 143.14 50.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.839 179.972 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 21.1 m -134.94 177.43 7.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.837 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -130.18 83.4 2.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.958 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.738 HD22 HD12 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -55.92 -34.75 65.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.916 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 65' ' ' LEU . 12.8 mmtt -117.92 163.72 23.2 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.681 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.8 -19.29 30.6 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.654 2.236 . . . . 0.0 112.467 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -148.66 76.38 1.35 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.711 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 62' ' ' LYS . 0.2 OUTLIER -175.57 122.13 0.2 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.139 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.407 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -89.95 157.03 18.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.2 179.464 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.96 HD21 HD12 ' A' ' 80' ' ' LEU . 5.6 tt -153.16 98.35 2.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.902 0.382 . . . . 0.0 111.391 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.542 HG22 ' HB2' ' A' ' 58' ' ' GLU . 34.8 t -94.09 134.1 32.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.284 179.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.465 ' HB3' HD13 ' A' ' 80' ' ' LEU . 5.1 p90 -146.26 158.28 43.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.996 0.427 . . . . 0.0 111.312 -179.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -135.24 109.35 8.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.637 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.568 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -84.97 141.22 14.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.837 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.69 103.54 10.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.72 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm -59.98 -19.71 53.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.417 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -30.34 36.4 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.747 0.308 . . . . 0.0 111.142 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -148.57 19.71 1.04 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.339 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 46.98 75.3 0.13 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.751 0.31 . . . . 0.0 111.283 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.42 HG23 ' HB ' ' A' ' 3' ' ' THR . 96.6 m -133.99 148.48 51.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.942 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.56 91.46 3.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.66 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.441 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 6.1 t80 -89.93 110.96 21.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.92 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.96 HD12 HD21 ' A' ' 67' ' ' LEU . 3.4 mm? -70.41 -178.01 1.62 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.603 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 82.5 t -152.47 -72.42 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.304 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.08 163.85 11.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.914 0.387 . . . . 0.0 111.096 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.464 HD13 ' C ' ' A' ' 83' ' ' LEU . 1.7 tm? -177.09 87.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.926 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.833 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 177.7 -136.61 3.1 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.512 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -140.32 147.86 40.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.744 0.307 . . . . 0.0 110.895 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -59.2 -39.8 83.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.062 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.1 t -75.42 -37.49 60.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.976 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.1 -57.82 5.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.922 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.557 HD21 ' OD1' ' A' ' 13' ' ' ASP . 2.2 mm? . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.856 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.833 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.843 0.354 . . . . 0.0 110.869 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.448 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -73.32 -175.72 2.0 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.793 179.937 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.777 HG12 HG11 ' A' ' 31' ' ' VAL . 4.1 mp -130.31 124.18 57.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.003 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -117.2 162.84 17.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.801 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 44.1 p -126.12 153.67 44.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.951 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.7 t -102.87 177.12 4.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.021 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.7 mtmm -74.02 -43.89 56.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.861 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.7 mmtm -79.07 -28.21 43.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.934 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.581 ' CE2' HD11 ' A' ' 14' ' ' LEU . 31.7 t80 -55.83 -34.33 65.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.978 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.474 ' HA ' HD12 ' A' ' 14' ' ' LEU . 73.6 m-20 -68.12 -31.69 71.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.867 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -78.63 -22.02 47.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.166 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.04 -27.34 33.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.107 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.581 HD11 ' CE2' ' A' ' 10' ' ' PHE . 4.8 mt -81.11 -37.77 28.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.106 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.458 ' HA ' HG12 ' A' ' 18' ' ' VAL . 15.7 ptmt -57.47 -28.85 63.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.129 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.9 mm -78.74 -28.72 14.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.328 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.623 ' CD1' HD21 ' A' ' 65' ' ' LEU . 26.5 mt -87.48 -40.68 14.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.115 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.458 HG12 ' HA ' ' A' ' 15' ' ' LYS . 12.5 p -57.62 -32.17 41.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.2 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt -77.54 -31.17 53.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.935 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -100.37 29.89 4.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.917 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.16 98.44 0.54 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.539 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.521 ' CE1' HD11 ' A' ' 26' ' ' LEU . 55.4 t80 -176.88 97.86 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.82 0.343 . . . . 0.0 110.932 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.406 ' HB3' HD23 ' A' ' 26' ' ' LEU . 4.7 t0 -68.83 160.87 29.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.889 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -94.21 -31.0 14.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.894 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.73 -34.86 73.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.977 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.521 HD11 ' CE1' ' A' ' 22' ' ' PHE . 4.2 pp -61.15 -35.68 77.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.869 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.501 ' HA ' HG12 ' A' ' 30' ' ' VAL . 4.5 tp -77.07 -29.48 55.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.972 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.627 ' O ' HG22 ' A' ' 31' ' ' VAL . 2.5 m-85 -79.49 -25.54 41.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.069 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.34 -32.06 17.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.088 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.501 HG12 ' HA ' ' A' ' 27' ' ' LEU . 13.7 p -71.39 -14.32 17.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.582 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.777 HG11 HG12 ' A' ' 4' ' ' ILE . 18.3 m -51.73 -46.35 38.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.841 0.353 . . . . 0.0 111.365 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.472 ' N ' HG23 ' A' ' 31' ' ' VAL . . . -62.65 -26.39 68.41 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.413 179.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -88.71 -19.59 25.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.637 0.256 . . . . 0.0 111.162 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.863 HD21 ' HB3' ' A' ' 61' ' ' LEU . 70.7 mt -72.23 -45.93 58.2 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.842 0.353 . . . . 0.0 111.012 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.446 ' HB2' HD11 ' A' ' 2' ' ' LEU . . . -63.83 -30.59 71.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.23 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 73.5 p -92.38 -35.61 13.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.899 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 60.01 61.59 1.84 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.874 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.47 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 2.5 mt-30 -79.94 -56.67 0.73 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.564 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.47 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 36.5 Cg_endo -66.27 -86.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.029 1.819 . . . . 0.0 112.327 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.484 HD22 ' N ' ' A' ' 40' ' ' LEU . 3.6 mm? 44.63 92.64 0.01 OUTLIER 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.775 0.321 . . . . 0.0 111.625 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.708 ' HB1' ' HD2' ' A' ' 42' ' ' PRO . . . -59.33 165.63 3.69 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.708 ' HD2' ' HB1' ' A' ' 41' ' ' ALA . 11.2 Cg_endo -54.6 -68.95 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.522 2.148 . . . . 0.0 112.196 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.04 -30.65 71.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.753 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -108.56 55.08 0.64 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.693 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.96 -162.22 0.94 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.766 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -113.2 155.2 25.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.869 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 11.3 p-80 -165.6 145.42 5.5 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.825 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo . . . . . 0 C--N 1.346 0.404 0 C-N-CA 122.597 2.198 . . . . 0.0 112.298 179.972 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.9 t0 . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.8 0.333 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.414 ' CD1' ' HB2' ' A' ' 70' ' ' GLN . 10.1 m-85 -64.85 157.93 26.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.9 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.2 mtt85 -166.84 137.37 3.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.846 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.407 ' CG ' HG22 ' A' ' 68' ' ' VAL . 31.1 tt0 -109.68 130.66 55.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.904 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.2 p -144.64 175.35 10.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.839 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 55.9 m-70 -129.36 93.06 3.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.838 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.863 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -59.5 -34.56 72.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.906 179.925 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.404 ' HB2' ' HB2' ' A' ' 65' ' ' LEU . 0.1 OUTLIER -110.28 164.99 13.52 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.677 179.955 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.61 -12.69 34.86 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.508 2.139 . . . . 0.0 112.81 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.796 ' O ' HD12 ' A' ' 65' ' ' LEU . 3.1 t0 -149.91 65.38 0.98 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.953 0.406 . . . . 0.0 110.967 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.796 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.1 OUTLIER -163.88 159.29 20.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.853 179.91 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.688 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.3 OUTLIER -116.72 169.77 9.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.831 179.845 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.938 HD13 HD12 ' A' ' 83' ' ' LEU . 15.6 tp -170.01 94.91 0.26 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.031 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.543 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 39.2 t -99.49 69.65 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.897 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.581 ' CD1' HD21 ' A' ' 78' ' ' LEU . 9.2 p90 -89.52 172.89 8.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.057 0.456 . . . . 0.0 111.487 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HB2' ' CD1' ' A' ' 56' ' ' PHE . 22.0 tt0 -142.72 141.06 31.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.641 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.568 ' N ' HD13 ' A' ' 71' ' ' ILE . 2.8 mm -84.79 147.91 5.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.357 -179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.444 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -122.28 87.81 2.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.616 179.522 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.8 mmtt -53.01 -23.87 8.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.388 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -47.18 -33.12 4.95 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.194 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -149.07 20.45 0.98 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.193 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.8 m120 47.29 67.8 0.74 Allowed 'General case' 0 C--O 1.231 0.106 0 CA-C-O 120.848 0.356 . . . . 0.0 111.261 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.448 HG23 ' HB ' ' A' ' 3' ' ' THR . 16.0 m -133.96 150.82 51.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.05 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.833 ' HB2' HD12 ' A' ' 2' ' ' LEU . 1.1 tt -102.34 100.6 10.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.407 179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 2.6 t80 -93.77 112.7 24.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.017 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.576 HD12 ' CE2' ' A' ' 10' ' ' PHE . 23.1 mt -67.39 175.18 2.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.712 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.543 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 73.2 t -149.39 -85.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.414 -179.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.547 ' O ' HD12 ' A' ' 67' ' ' LEU . 2.7 mtt85 -99.0 162.51 13.03 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.917 0.389 . . . . 0.0 111.059 -179.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.938 HD12 HD13 ' A' ' 67' ' ' LEU . 1.3 tt -176.5 127.48 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.87 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.688 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 154.87 -166.5 32.46 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.437 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.8 m -118.3 145.56 44.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.854 0.359 . . . . 0.0 110.903 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 13.2 p80 -62.22 -34.54 76.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.9 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.88 -34.08 77.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.909 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -79.61 -63.98 1.29 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.942 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.5 mp . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.829 -179.982 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.63 HD23 ' HA ' ' A' ' 76' ' ' ASN . 1.7 mp . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.788 0.328 . . . . 0.0 110.825 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.96 -177.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.802 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.4 mp -132.14 107.36 12.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.167 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -105.28 167.63 9.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.654 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.8 p -135.87 157.65 46.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.172 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.44 ' HB3' ' CE1' ' A' ' 79' ' ' PHE . 59.8 p -113.86 -176.57 2.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.04 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.9 mmmt -71.16 -58.41 3.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.848 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 26.4 mttp -58.38 -30.36 66.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.876 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CZ ' HD13 ' A' ' 80' ' ' LEU . 93.3 t80 -58.66 -33.72 70.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -66.71 -43.19 84.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.954 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.1 mttt -74.36 -20.12 60.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.237 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.491 ' OD1' HD21 ' A' ' 89' ' ' LEU . 1.3 m-20 -86.47 -27.31 24.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.181 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.89 -36.74 19.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.117 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.483 ' HE3' HD11 ' A' ' 16' ' ' ILE . 1.5 pttt -58.51 -29.06 65.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.209 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.483 HD11 ' HE3' ' A' ' 15' ' ' LYS . 30.2 mm -81.46 -29.16 10.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.285 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.408 HD13 ' CD2' ' A' ' 83' ' ' LEU . 24.3 mt -82.11 -39.94 22.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.076 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.8 p -58.19 -30.44 39.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.163 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.86 -28.99 25.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.932 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -98.45 31.19 2.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.833 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.21 90.57 0.93 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.524 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.577 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 11.1 t80 -175.43 93.76 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.821 0.343 . . . . 0.0 110.863 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -69.81 167.12 17.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.849 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -92.1 -31.01 15.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.962 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.83 -34.61 73.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.577 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 3.9 pp -60.12 -35.51 75.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.938 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.473 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.2 OUTLIER -67.75 -29.71 68.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.897 179.997 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.634 ' O ' HG12 ' A' ' 31' ' ' VAL . 18.6 m-85 -82.27 -28.83 31.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.956 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.2 -32.83 19.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.037 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.464 HG12 ' HA ' ' A' ' 27' ' ' LEU . 14.7 p -68.25 -21.33 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.418 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.634 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.0 p -48.43 -29.29 2.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.437 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.02 -29.35 72.4 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.458 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -89.99 -26.74 20.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.687 0.279 . . . . 0.0 110.956 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.457 HD22 ' CD2' ' A' ' 67' ' ' LEU . 65.8 mt -63.92 -42.77 97.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.943 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.75 -35.98 70.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.067 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.0 p -76.67 -46.61 24.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.89 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.757 ' HA ' HD11 ' A' ' 40' ' ' LEU . 40.2 mt-10 59.34 48.84 9.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.919 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.407 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 2.1 mt-30 -90.27 -52.1 0.33 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.195 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.407 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 73.6 Cg_endo -83.36 -92.77 0.0 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.381 2.054 . . . . 0.0 112.823 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.757 HD11 ' HA ' ' A' ' 37' ' ' GLU . 0.5 OUTLIER 53.82 28.95 8.96 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-O 120.801 0.334 . . . . 0.0 111.025 -179.951 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.477 ' HB1' ' HE2' ' A' ' 43' ' ' LYS . . . 66.66 140.77 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.001 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.38 -40.65 2.93 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.511 2.141 . . . . 0.0 112.563 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.477 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -54.09 -42.06 68.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.114 -179.754 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.457 ' CE1' ' HG3' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -146.17 72.21 1.28 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.947 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.4 mttt -56.63 -79.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.984 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.1 t0 -178.4 140.28 0.2 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.752 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 16.9 p-80 -146.54 145.16 22.43 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo . . . . . 0 C--N 1.345 0.352 0 C-N-CA 122.499 2.133 . . . . 0.0 112.365 -179.959 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 . . . . . 0 C--O 1.23 0.041 0 CA-C-O 120.818 0.342 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -60.29 150.98 28.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.92 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 -161.91 142.91 10.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.742 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -125.82 140.31 52.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.145 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.716 ' HB2' HD22 ' A' ' 40' ' ' LEU . 31.6 p -144.31 160.29 41.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.804 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -108.31 82.19 1.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.985 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.482 HD23 ' HB2' ' A' ' 67' ' ' LEU . 3.9 pp -59.76 -33.24 71.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.823 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.573 ' HD2' HD13 ' A' ' 65' ' ' LEU . 1.0 OUTLIER -110.72 170.36 5.37 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.643 179.845 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.44 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 43.4 Cg_endo -68.43 -8.6 23.53 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.431 2.087 . . . . 0.0 112.893 -179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.816 ' O ' HD12 ' A' ' 65' ' ' LEU . 1.4 t0 -158.49 58.79 0.45 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.865 0.364 . . . . 0.0 111.038 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.816 HD12 ' O ' ' A' ' 64' ' ' ASP . 3.4 mp -151.9 150.84 30.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.054 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.692 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -119.22 106.78 12.68 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.501 179.796 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.55 HD11 HD22 ' A' ' 80' ' ' LEU . 40.0 tp -96.28 97.26 9.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.95 0.405 . . . . 0.0 111.479 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.501 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 27.6 t -94.85 123.73 47.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.062 178.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.477 ' CD1' ' CD1' ' A' ' 71' ' ' ILE . 2.4 p90 -140.8 177.71 7.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.915 0.388 . . . . 0.0 111.285 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.83 106.49 4.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.643 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.614 HG23 HD22 ' A' ' 2' ' ' LEU . 1.5 mp -84.96 137.85 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.896 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.401 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -118.01 101.72 8.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.568 179.739 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.6 ptpp? -60.19 -20.72 59.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.279 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.65 -32.01 49.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.838 0.352 . . . . 0.0 111.025 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -145.21 17.14 1.54 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.273 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.63 ' HA ' HD23 ' A' ' 2' ' ' LEU . 21.2 m120 46.92 74.46 0.15 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.789 0.328 . . . . 0.0 111.336 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.401 ' HB ' ' CG ' ' A' ' 72' ' ' LYS . 98.6 m -134.08 139.48 45.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.925 0.393 . . . . 0.0 110.955 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.06 94.36 5.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.639 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.44 ' CE1' ' HB3' ' A' ' 7' ' ' SER . 3.4 t80 -92.2 112.88 24.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.986 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.55 HD22 HD11 ' A' ' 67' ' ' LEU . 16.1 mt -71.66 171.07 12.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.707 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.501 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 92.7 t -147.65 -65.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.084 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -115.73 166.03 12.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.06 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.549 HD23 HD23 ' A' ' 65' ' ' LEU . 0.9 OUTLIER -178.92 119.73 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.885 179.899 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.692 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 143.63 -168.53 26.3 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.449 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.497 ' O ' HD23 ' A' ' 89' ' ' LEU . 8.1 t -100.32 172.59 7.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.852 0.358 . . . . 0.0 110.972 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -79.04 -40.46 31.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.857 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.7 m -74.26 -31.35 62.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.871 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.15 -31.86 70.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.85 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.497 HD23 ' O ' ' A' ' 85' ' ' SER . 3.1 mm? . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.785 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 mt . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.849 0.357 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.551 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -60.19 -175.47 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.763 -179.971 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -132.04 118.13 35.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.073 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -111.79 168.65 9.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.896 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.6 p -143.45 148.41 36.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.999 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 6.9 p -109.81 -171.1 1.77 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.903 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm -79.78 -33.92 40.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.668 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.407 ' HA ' ' CD ' ' A' ' 12' ' ' LYS . 4.5 mttp -80.5 -26.45 38.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.934 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.596 ' HZ ' HD11 ' A' ' 27' ' ' LEU . 35.9 t80 -72.01 -30.63 65.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.934 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.12 -39.38 49.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.128 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.407 ' CD ' ' HA ' ' A' ' 9' ' ' LYS . 2.2 ptmm? -75.74 -13.14 60.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.421 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -90.11 -32.33 16.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.686 0.279 . . . . 0.0 111.056 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.405 HD12 HD12 ' A' ' 83' ' ' LEU . 1.3 tp -79.48 -40.17 30.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.165 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -57.4 -23.28 48.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.234 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.9 mm -86.05 -29.86 6.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.172 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.445 HD11 ' CA ' ' A' ' 84' ' ' GLY . 4.3 mt -85.96 -34.02 20.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.934 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.3 p -60.42 -34.91 59.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.1 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.03 -46.09 58.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.844 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -73.15 -30.9 63.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.928 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 146.91 84.91 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.41 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.577 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 8.3 t80 -164.66 99.11 0.79 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.712 0.291 . . . . 0.0 110.882 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.73 166.22 11.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.843 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.3 mp -98.04 -29.99 12.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.859 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.7 -32.64 74.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.957 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.577 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 4.0 pp -59.6 -31.69 69.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.855 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.596 HD11 ' HZ ' ' A' ' 10' ' ' PHE . 0.9 OUTLIER -67.97 -26.66 66.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.066 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.679 ' O ' HG12 ' A' ' 31' ' ' VAL . 32.3 m-85 -79.76 -26.83 40.57 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.058 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.72 -29.64 19.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.16 -179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.535 HG12 ' HA ' ' A' ' 27' ' ' LEU . 14.8 p -74.25 -25.56 19.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.213 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.679 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.6 p -49.03 -29.36 2.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.333 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -67.57 -29.11 73.68 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.342 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -89.99 -32.77 16.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.911 0.386 . . . . 0.0 110.958 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 40.6 mt -68.08 -41.64 81.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.833 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.07 -40.02 94.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.118 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 68.3 p -75.67 -36.68 60.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.876 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.943 ' HA ' HD21 ' A' ' 40' ' ' LEU . 27.5 mt-10 59.8 52.54 5.36 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.863 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -96.42 -52.82 0.22 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.595 -179.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -81.78 -82.57 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.383 2.055 . . . . 0.0 113.238 -179.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.943 HD21 ' HA ' ' A' ' 37' ' ' GLU . 0.6 OUTLIER 48.69 40.72 16.43 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.895 0.378 . . . . 0.0 111.136 -179.506 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.69 132.66 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.085 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.407 ' HA ' ' HD2' ' A' ' 45' ' ' LYS . 70.1 Cg_endo -74.24 -25.26 13.72 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.497 2.131 . . . . 0.0 112.451 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.31 -28.34 38.23 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.071 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.42 ' HB3' ' CD2' ' A' ' 60' ' ' HIS . 14.6 m-85 -103.19 -61.5 1.4 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.026 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.407 ' HD2' ' HA ' ' A' ' 42' ' ' PRO . 0.0 OUTLIER 63.9 140.38 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.839 -179.958 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.577 ' OD1' HD23 ' A' ' 40' ' ' LEU . 4.2 p-10 -59.7 151.17 25.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.909 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -162.76 146.65 8.97 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo . . . . . 0 C--N 1.346 0.402 0 C-N-CA 122.462 2.108 . . . . 0.0 112.366 179.97 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.827 0.346 . . . . 0.0 110.973 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -66.0 176.01 1.83 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.009 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -177.41 130.57 0.16 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.65 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.464 ' HG3' HG22 ' A' ' 68' ' ' VAL . 24.2 tt0 -103.23 137.98 40.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.985 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 15.1 m -141.97 -176.29 4.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.83 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.42 ' CD2' ' HB3' ' A' ' 44' ' ' TYR . 23.4 m-70 -143.26 93.76 2.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.914 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.999 HD22 HD12 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -70.66 -29.55 65.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.902 179.858 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.501 ' HB2' HD13 ' A' ' 65' ' ' LEU . 1.2 mttp -121.69 162.77 34.83 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.809 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.69 -12.76 32.94 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.602 2.202 . . . . 0.0 112.772 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.589 ' O ' HD12 ' A' ' 65' ' ' LEU . 20.6 t70 -148.75 65.7 1.05 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.83 0.348 . . . . 0.0 111.254 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.589 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.8 OUTLIER -163.25 149.61 12.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.025 179.886 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.71 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.3 OUTLIER -115.86 149.01 39.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.633 179.817 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.999 HD12 HD22 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -149.66 93.32 2.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.131 -179.834 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.508 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 38.7 t -95.37 69.4 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.968 0.413 . . . . 0.0 110.794 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.689 ' HD2' HD22 ' A' ' 67' ' ' LEU . 9.9 p90 -89.64 168.64 11.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.457 -179.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.591 ' C ' HD12 ' A' ' 71' ' ' ILE . 5.7 pt20 -137.64 141.13 41.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.692 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.591 HD12 ' C ' ' A' ' 70' ' ' GLN . 1.4 mp -108.79 119.67 58.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.792 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.408 ' HB2' ' HG2' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -93.23 99.21 11.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.655 179.831 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.3 mttp -60.73 -28.1 68.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.359 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.408 ' HG2' ' HB2' ' A' ' 72' ' ' LYS . 4.8 pt20 -52.87 -28.36 22.7 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.836 0.351 . . . . 0.0 111.149 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -139.7 10.94 2.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.558 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 46.82 76.14 0.11 Allowed 'General case' 0 N--CA 1.461 0.1 0 CA-C-O 120.838 0.351 . . . . 0.0 111.335 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.551 HG23 ' HB ' ' A' ' 3' ' ' THR . 54.8 m -139.85 150.21 44.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.933 0.397 . . . . 0.0 111.036 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.627 HD23 HG23 ' A' ' 31' ' ' VAL . 23.0 tp -107.14 93.84 4.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.434 179.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 4.3 t80 -89.87 107.33 19.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.841 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.557 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 1.9 mt -71.36 173.93 7.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.96 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.508 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 90.5 t -151.92 -84.55 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.203 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.492 ' CZ ' HD13 ' A' ' 66' ' ' LEU . 34.8 ttt180 -83.42 163.28 20.65 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.949 0.404 . . . . 0.0 110.771 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.458 HD13 HD23 ' A' ' 65' ' ' LEU . 1.3 tm? -175.49 95.12 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.889 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.71 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 144.25 -168.67 26.56 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.622 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.9 t -112.96 159.41 19.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.756 0.312 . . . . 0.0 110.97 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -62.43 -39.34 93.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.909 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 23.6 m -71.4 -33.22 69.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.921 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.33 -48.12 65.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.884 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.023 179.942 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.8 mmt . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 120.936 0.398 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.616 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -97.65 130.83 44.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.922 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.53 -174.5 0.55 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.872 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -130.27 114.66 29.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.992 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.65 164.49 11.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.795 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 32.7 p -134.76 151.3 50.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.943 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.411 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 8.1 t -105.29 -169.52 1.61 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.07 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.0 mtmt -81.59 -56.44 4.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.887 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.2 mtmt -58.85 -30.76 67.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.825 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -63.62 -46.52 85.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.777 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -58.73 -30.8 67.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.963 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.13 -6.04 59.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.55 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.96 -49.67 6.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.817 0.341 . . . . 0.0 111.194 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.468 HD12 HD22 ' A' ' 83' ' ' LEU . 1.3 tp -59.43 -38.3 80.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.338 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.2 ptpp? -56.96 -26.46 59.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.316 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 29.1 mm -85.19 -28.56 6.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.375 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.682 HD11 ' HA2' ' A' ' 84' ' ' GLY . 7.1 mt -86.29 -32.47 21.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.138 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 p -64.49 -31.59 54.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.06 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.14 -40.2 38.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.932 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -77.64 -39.01 46.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.943 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 156.89 89.4 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.479 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -154.56 168.1 27.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.819 0.342 . . . . 0.0 110.876 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -122.01 155.31 35.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.946 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.4 mp -83.77 -50.86 7.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.982 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.2 ttmm -65.02 -21.05 66.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.123 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.595 ' O ' HD13 ' A' ' 26' ' ' LEU . 3.2 tm? -52.85 -43.06 65.78 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.079 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.518 ' O ' HG12 ' A' ' 30' ' ' VAL . 5.8 tp -64.23 -54.24 36.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.866 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.616 ' O ' HG12 ' A' ' 31' ' ' VAL . 14.4 m-85 -62.96 -18.27 62.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.953 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -90.07 -36.99 14.57 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.185 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.518 HG12 ' O ' ' A' ' 27' ' ' LEU . 9.5 p -71.8 -20.99 20.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.451 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.616 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.5 p -49.35 -40.52 14.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.368 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.406 ' N ' HG13 ' A' ' 31' ' ' VAL . . . -59.91 -28.62 66.29 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.354 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -89.98 -22.62 21.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.791 0.329 . . . . 0.0 111.096 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.5 mt -74.5 -35.86 63.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.854 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.05 -31.33 62.83 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.282 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 65.9 p -94.43 -34.7 12.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.937 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.914 ' HA ' HD21 ' A' ' 40' ' ' LEU . 3.2 mt-10 60.1 62.17 1.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.739 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.55 -51.68 0.23 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.857 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -80.49 -80.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.337 2.025 . . . . 0.0 113.349 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.914 HD21 ' HA ' ' A' ' 37' ' ' GLU . 2.0 mm? 46.67 27.95 0.73 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.633 0.254 . . . . 0.0 111.432 -179.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.89 ' HB3' ' HB2' ' A' ' 44' ' ' TYR . . . 59.54 117.25 0.02 OUTLIER Pre-proline 0 CA--C 1.53 0.193 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.232 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -52.99 -41.92 68.09 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.461 2.107 . . . . 0.0 112.589 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.12 -26.76 60.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.32 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.89 ' HB2' ' HB3' ' A' ' 41' ' ' ALA . 3.5 m-85 -87.85 -66.42 0.92 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.839 0.352 . . . . 0.0 110.988 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.01 117.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.2 p-10 -56.1 157.25 4.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.061 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -162.01 155.18 17.42 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.949 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.91 -176.49 1.83 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.528 2.152 . . . . 0.0 112.286 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -114.31 -48.98 2.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.979 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.2 mttp 61.45 169.65 0.11 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.803 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 98.88 47.29 1.94 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.4 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 96.75 -30.15 9.36 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.508 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.444 ' HB3' ' CD2' ' A' ' 56' ' ' PHE . 1.8 mt -118.41 87.01 2.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.864 0.364 . . . . 0.0 110.798 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.0 ptpt -76.44 -25.24 54.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.148 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 56' ' ' PHE . 4.0 m-20 -84.34 54.75 3.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.888 0.375 . . . . 0.0 110.908 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.444 ' CD2' ' HB3' ' A' ' 53' ' ' LEU . 67.8 m-85 -157.05 122.88 4.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.851 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -143.41 139.89 30.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.719 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.481 ' HG3' HG22 ' A' ' 68' ' ' VAL . 10.8 tt0 -121.51 143.09 49.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.987 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.76 ' HB2' HD12 ' A' ' 40' ' ' LEU . 31.8 p -131.28 -174.33 3.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.693 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.445 ' CE1' HD23 ' A' ' 66' ' ' LEU . 34.8 m-70 -143.14 90.49 2.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.987 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.648 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.1 pp -59.64 -41.28 90.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.721 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.648 ' N ' HD12 ' A' ' 61' ' ' LEU . 0.5 OUTLIER -101.61 166.05 12.94 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.832 179.867 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.0 -11.86 32.9 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.561 2.174 . . . . 0.0 112.594 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.52 ' O ' HD12 ' A' ' 65' ' ' LEU . 0.8 OUTLIER -145.57 48.18 1.26 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.8 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.52 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.1 OUTLIER -156.68 132.19 9.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.168 -179.85 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.621 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -99.03 177.81 5.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.247 179.48 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.491 HD23 ' C ' ' A' ' 67' ' ' LEU . 5.7 tt -166.37 99.11 0.6 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.899 0.38 . . . . 0.0 111.403 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.481 HG22 ' HG3' ' A' ' 58' ' ' GLU . 16.4 t -90.0 136.41 23.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.115 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.879 ' HA ' HG23 ' A' ' 81' ' ' VAL . 7.3 p90 -153.03 169.69 22.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.925 0.393 . . . . 0.0 111.447 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -140.01 123.58 17.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.68 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.513 ' N ' HD13 ' A' ' 71' ' ' ILE . 2.9 mm -84.82 150.28 4.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.329 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.425 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -134.48 87.06 2.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.76 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -21.14 43.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.213 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -50.85 -31.34 16.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.753 0.311 . . . . 0.0 111.021 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -144.0 17.48 1.76 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.201 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 47.99 71.91 0.31 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.809 0.337 . . . . 0.0 111.286 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.425 ' HB ' ' CG ' ' A' ' 72' ' ' LYS . 55.4 m -138.21 145.77 41.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.022 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.616 ' HB2' HD12 ' A' ' 2' ' ' LEU . 1.0 OUTLIER -105.2 95.15 5.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.669 179.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.411 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.1 t80 -92.16 115.68 28.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.014 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.406 ' O ' ' CE1' ' A' ' 79' ' ' PHE . 20.0 mt -76.19 168.3 20.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.673 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.879 HG23 ' HA ' ' A' ' 69' ' ' TYR . 48.0 t -131.85 -68.94 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.086 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -128.16 167.06 17.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.951 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.468 HD22 HD12 ' A' ' 14' ' ' LEU . 9.7 tt -171.9 134.75 0.79 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.834 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.682 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 143.28 -149.51 21.44 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.581 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.8 150.08 48.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.818 0.342 . . . . 0.0 110.804 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -59.99 -43.36 95.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.824 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.7 p -70.82 -32.96 70.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.92 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.49 -56.59 6.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.861 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.0 mp -60.85 -38.96 87.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.856 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.134 -0.936 . . . . 0.0 110.884 -179.914 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 mtm . . . . . 0 N--CA 1.488 1.427 0 CA-C-O 120.791 0.329 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.448 HD23 ' HB3' ' A' ' 76' ' ' ASN . 1.4 mt -135.56 147.44 48.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.76 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.507 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -60.13 -176.47 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.829 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.444 ' N ' HD12 ' A' ' 4' ' ' ILE . 4.3 mp -128.5 113.93 31.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.171 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.425 ' O ' HD12 ' A' ' 80' ' ' LEU . 4.3 mm-40 -114.29 165.83 12.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.763 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 63.0 p -132.57 162.42 31.33 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.023 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.418 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 1.0 OUTLIER -118.64 -176.53 3.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.918 -179.948 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.68 -47.36 32.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.856 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.9 mttt -67.52 -34.56 77.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.857 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.53 ' CE2' HD13 ' A' ' 80' ' ' LEU . 60.9 t80 -63.22 -31.22 72.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -69.29 -53.38 20.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.91 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -13.33 61.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.318 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.426 ' OD2' HD21 ' A' ' 89' ' ' LEU . 0.7 OUTLIER -82.15 -29.2 31.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.774 0.321 . . . . 0.0 110.998 -179.956 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.58 -31.71 63.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.983 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.411 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -62.71 -26.48 68.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.058 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.1 mm -81.48 -29.74 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.21 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.696 HD21 ' HA2' ' A' ' 84' ' ' GLY . 3.3 mm? -84.51 -36.25 22.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.081 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.411 HG12 ' HA ' ' A' ' 15' ' ' LYS . 11.8 p -63.81 -33.75 63.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.133 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.7 tptt -71.23 -36.35 71.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -87.6 -24.25 24.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.961 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 138.3 94.69 0.32 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.354 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.836 ' CE1' HD11 ' A' ' 26' ' ' LEU . 50.5 t80 -167.64 125.56 1.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.82 0.343 . . . . 0.0 110.988 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.479 ' C ' HD22 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -94.95 -176.44 3.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.7 -179.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.507 HD22 ' N ' ' A' ' 24' ' ' LEU . 3.5 mm? -111.73 -32.14 6.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.95 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.57 -29.87 68.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.957 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.836 HD11 ' CE1' ' A' ' 22' ' ' PHE . 4.2 pp -72.9 -31.33 64.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.992 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.616 HD12 ' CZ ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -72.67 -26.48 61.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.023 179.976 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.497 ' O ' HG12 ' A' ' 31' ' ' VAL . 6.7 m-85 -86.3 -29.31 23.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.897 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.19 -32.53 19.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.969 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.6 p -62.21 -18.56 20.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.267 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.497 HG12 ' O ' ' A' ' 28' ' ' TYR . 11.6 p -50.97 -43.41 25.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.755 0.312 . . . . 0.0 111.26 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.463 ' N ' HG13 ' A' ' 31' ' ' VAL . . . -59.19 -28.12 63.71 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.355 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.7 m-20 -89.96 -24.26 21.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.796 0.331 . . . . 0.0 111.006 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 68.4 mt -72.51 -34.01 67.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.942 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.96 -39.06 30.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.232 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.0 p -83.88 -38.99 20.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.886 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.749 ' HB3' HD11 ' A' ' 40' ' ' LEU . 8.4 mt-10 59.71 66.69 0.96 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.925 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.403 ' CB ' ' HD3' ' A' ' 39' ' ' PRO . 0.5 OUTLIER -94.56 -53.11 0.24 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.16 -179.912 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.403 ' HD3' ' CB ' ' A' ' 38' ' ' GLN . 60.8 Cg_endo -85.82 -88.97 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.611 2.207 . . . . 0.0 112.81 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.749 HD11 ' HB3' ' A' ' 37' ' ' GLU . 0.4 OUTLIER 59.32 21.25 9.49 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.67 0.272 . . . . 0.0 111.038 -179.898 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.642 ' HB1' ' HE3' ' A' ' 43' ' ' LYS . . . 63.31 128.73 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.002 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.17 -23.55 21.08 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.426 2.084 . . . . 0.0 112.476 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.642 ' HE3' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.35 -30.63 42.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.069 -179.954 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.419 ' HB3' ' CD2' ' A' ' 60' ' ' HIS . 59.2 m-85 -101.56 -58.04 1.96 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.077 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.7 mttt 62.52 149.64 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.883 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -92.13 161.47 14.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.87 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -159.25 158.73 28.64 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.914 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.45 ' HA ' ' HB3' ' A' ' 57' ' ' ARG . 68.2 Cg_endo -74.38 -4.14 14.94 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.654 2.236 . . . . 0.0 112.787 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.451 HD12 ' HA ' ' A' ' 57' ' ' ARG . 0.2 OUTLIER 75.03 -60.23 0.52 Allowed 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.785 0.326 . . . . 0.0 110.988 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.8 mttm 64.76 173.25 0.2 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.871 0.367 . . . . 0.0 110.918 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 96.35 36.28 5.2 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.312 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.81 -30.64 9.7 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.49 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 11.2 mt -119.9 68.84 0.84 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.877 0.37 . . . . 0.0 110.829 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -67.96 -31.15 70.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.862 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.78 -34.16 77.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.833 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -84.86 138.79 32.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.868 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.451 ' HA ' HD12 ' A' ' 49' ' ' LEU . 0.5 OUTLIER -156.73 155.21 31.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.887 -179.934 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.547 ' HB2' HG22 ' A' ' 68' ' ' VAL . 33.3 tt0 -130.15 133.87 46.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.972 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 28.9 p -119.09 -172.04 2.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.798 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.419 ' CD2' ' HB3' ' A' ' 44' ' ' TYR . 68.7 m-70 -140.5 79.9 1.73 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.887 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.504 ' CD2' HD12 ' A' ' 67' ' ' LEU . 1.1 pp -55.91 -50.63 70.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.866 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.489 ' N ' HD12 ' A' ' 61' ' ' LEU . 6.7 mttt -95.15 167.69 12.43 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.705 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 38.2 Cg_endo -66.66 -12.78 37.25 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.545 2.163 . . . . 0.0 112.604 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.855 ' O ' HD12 ' A' ' 65' ' ' LEU . 5.9 t70 -150.92 51.74 0.86 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.677 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.855 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.4 OUTLIER -156.5 130.47 8.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.065 -179.823 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.467 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -104.21 160.92 14.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.295 179.555 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.504 HD12 ' CD2' ' A' ' 61' ' ' LEU . 5.1 tt -148.78 102.62 3.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.854 0.359 . . . . 0.0 111.344 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.547 HG22 ' HB2' ' A' ' 58' ' ' GLU . 25.7 t -90.01 128.78 41.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.231 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.804 ' HA ' HG23 ' A' ' 81' ' ' VAL . 12.1 p90 -150.08 165.94 31.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.909 0.385 . . . . 0.0 111.13 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -145.95 124.38 12.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.858 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.569 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -90.39 151.85 3.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.893 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.414 ' HB2' ' CG ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -120.62 104.0 9.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.733 179.758 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.76 -24.53 64.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.374 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.414 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 1.5 pt20 -53.22 -33.9 54.81 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.089 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -142.95 15.5 1.92 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.444 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.448 ' HB3' HD23 ' A' ' 2' ' ' LEU . 6.9 m-20 46.12 74.32 0.15 Allowed 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.78 0.324 . . . . 0.0 111.332 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.507 HG23 ' HB ' ' A' ' 3' ' ' THR . 98.8 m -136.08 140.34 43.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.933 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.512 HD21 ' CD2' ' A' ' 69' ' ' TYR . 0.6 OUTLIER -95.82 90.51 5.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.686 179.919 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.418 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 2.9 t80 -90.0 106.94 18.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.916 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.53 HD13 ' CE2' ' A' ' 10' ' ' PHE . 3.4 mt -64.53 169.46 4.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.767 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.804 HG23 ' HA ' ' A' ' 69' ' ' TYR . 42.5 t -131.86 -69.81 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.174 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.8 mmm-85 -132.98 178.57 6.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.847 0.356 . . . . 0.0 111.101 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.41 HD12 ' HG ' ' A' ' 67' ' ' LEU . 7.7 tt -177.89 144.34 0.35 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.93 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.696 ' HA2' HD21 ' A' ' 17' ' ' LEU . . . 139.72 -131.72 5.28 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.576 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 39.3 t -147.98 147.12 29.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.769 0.319 . . . . 0.0 110.938 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -59.69 -30.95 69.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.838 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.2 m -78.87 -37.04 41.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.87 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -68.52 -55.43 11.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.854 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.426 HD21 ' OD2' ' A' ' 13' ' ' ASP . 4.3 mp -63.84 -72.3 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.862 179.934 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.5 ttm . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.871 0.367 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.622 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -99.0 131.86 44.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.838 179.921 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.493 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -57.73 -177.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.039 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.9 mp -131.64 130.43 62.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.055 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -121.57 165.94 14.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.803 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 43.1 p -127.43 160.14 32.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.026 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.421 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 0.5 OUTLIER -117.32 -176.37 2.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.912 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 ptpt -76.78 -47.14 22.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.857 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.7 mtpt -67.96 -31.18 70.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.775 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.709 ' CE1' HD23 ' A' ' 14' ' ' LEU . 56.2 t80 -59.65 -39.36 84.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.87 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.85 -34.51 78.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.939 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 mttm -78.54 -24.73 45.5 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.158 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.556 ' OD1' HD11 ' A' ' 89' ' ' LEU . 3.8 m-20 -87.72 -28.58 21.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.109 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.709 HD23 ' CE1' ' A' ' 10' ' ' PHE . 0.1 OUTLIER -80.37 -28.41 38.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.14 -179.832 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 11.8 pttt -70.83 -28.53 64.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.267 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 28.4 mm -83.21 -45.17 18.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.312 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.545 HD12 HD13 ' A' ' 83' ' ' LEU . 5.4 mt -63.07 -40.35 97.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.012 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.433 HG12 ' O ' ' A' ' 14' ' ' LEU . 11.7 p -64.27 -29.85 48.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.106 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -77.33 -37.51 52.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.903 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -82.24 -49.25 10.3 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.899 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 170.26 89.44 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.486 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.848 ' CE1' HD11 ' A' ' 26' ' ' LEU . 56.0 t80 -174.34 151.69 1.65 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.859 0.362 . . . . 0.0 110.856 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -126.7 159.2 34.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.908 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -89.46 -29.42 19.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.005 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -58.31 -41.49 84.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.896 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.848 HD11 ' CE1' ' A' ' 22' ' ' PHE . 3.9 pp -66.45 -31.34 72.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.861 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.526 ' HA ' HG12 ' A' ' 30' ' ' VAL . 5.3 tt -66.77 -28.37 68.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.041 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.549 ' O ' HG12 ' A' ' 31' ' ' VAL . 0.3 OUTLIER -78.84 -30.05 45.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.939 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -84.28 -35.58 23.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.065 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.526 HG12 ' HA ' ' A' ' 27' ' ' LEU . 14.6 p -69.63 -11.95 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.499 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.549 HG12 ' O ' ' A' ' 28' ' ' TYR . 11.7 p -50.83 -41.57 21.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.858 0.361 . . . . 0.0 111.261 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.418 ' N ' HG13 ' A' ' 31' ' ' VAL . . . -69.68 -28.37 72.23 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.297 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -84.66 -19.91 32.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.715 0.293 . . . . 0.0 111.21 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.524 HD21 ' CD2' ' A' ' 61' ' ' LEU . 79.3 mt -70.88 -45.38 64.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.798 0.332 . . . . 0.0 110.956 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.22 -50.17 66.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.242 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.8 p -75.26 -37.05 61.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.928 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 61.09 54.69 3.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.903 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.451 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 3.5 mt-30 -79.42 -52.59 1.13 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.31 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.451 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 56.0 Cg_endo -73.09 -88.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.065 1.843 . . . . 0.0 112.544 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.0 mp 51.95 -178.49 0.02 OUTLIER 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.758 0.313 . . . . 0.0 111.077 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.4 ' HB3' ' CD2' ' A' ' 44' ' ' TYR . . . -122.17 114.74 30.54 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.161 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.13 71.1 2.27 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.5 2.133 . . . . 0.0 112.299 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.4 ' HD3' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -168.75 -41.0 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.959 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.423 ' HB2' ' CG ' ' A' ' 60' ' ' HIS . 16.2 m-85 -85.54 5.47 31.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.42 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp 62.52 145.98 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.888 0.375 . . . . 0.0 110.978 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -156.04 109.3 2.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.874 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.439 ' CG ' ' HD2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -169.8 167.01 5.31 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.744 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.439 ' HD2' ' CG ' ' A' ' 47' ' ' HIS . 43.1 Cg_endo -68.11 -176.11 0.97 Allowed 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.514 2.143 . . . . 0.0 112.306 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.8 mt -127.13 -176.02 3.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.868 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -150.97 177.5 10.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.929 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.2 55.39 3.75 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.503 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 95.08 -20.47 49.05 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.678 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.1 mt -119.55 92.27 3.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.798 0.332 . . . . 0.0 110.989 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.4 mtpp -97.1 -45.46 6.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.884 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -69.79 -22.96 63.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.155 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -69.28 133.09 47.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.009 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 21.4 mtp180 -150.75 150.83 31.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.743 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -139.17 120.87 15.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.883 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.1 p -127.82 150.78 49.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.875 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.423 ' CG ' ' HB2' ' A' ' 44' ' ' TYR . 10.8 m-70 -102.44 78.43 1.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.999 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.728 HD12 ' HG2' ' A' ' 62' ' ' LYS . 2.2 pp -58.99 -33.25 70.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.974 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.728 ' HG2' HD12 ' A' ' 61' ' ' LEU . 1.1 mmmm -127.61 159.66 64.78 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.713 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.54 122.71 12.12 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.649 2.232 . . . . 0.0 112.273 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 61.7 39.85 13.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.971 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -138.36 104.04 5.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.914 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.688 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -95.72 123.28 39.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.554 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.967 HD21 HD12 ' A' ' 80' ' ' LEU . 7.9 tt -117.82 99.51 6.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.945 0.402 . . . . 0.0 111.168 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.561 HG23 ' HB3' ' A' ' 82' ' ' ARG . 16.3 t -89.79 138.68 18.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.081 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.628 ' HA ' HG23 ' A' ' 81' ' ' VAL . 40.0 p90 -147.09 -178.07 6.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.086 0.469 . . . . 0.0 111.57 -179.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -162.1 111.45 1.49 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.574 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.542 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -84.7 146.62 6.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.058 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.06 103.95 11.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.742 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.08 -22.21 26.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.328 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -47.49 -36.65 10.54 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.289 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -148.26 21.03 1.08 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.268 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 26.4 m-20 48.27 71.92 0.31 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.914 0.387 . . . . 0.0 111.117 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.493 HG23 ' HB ' ' A' ' 3' ' ' THR . 99.7 m -128.71 147.54 50.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.911 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.622 ' HB2' HD12 ' A' ' 2' ' ' LEU . 0.7 OUTLIER -102.5 92.63 4.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.727 179.844 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.421 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 2.1 t80 -91.19 102.7 15.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.872 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.967 HD12 HD21 ' A' ' 67' ' ' LEU . 3.6 mm? -63.65 167.21 6.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.716 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.628 HG23 ' HA ' ' A' ' 69' ' ' TYR . 59.3 t -137.92 -66.62 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.971 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.561 ' HB3' HG23 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -114.39 163.34 15.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.974 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.766 HD23 HD12 ' A' ' 67' ' ' LEU . 3.1 tm? -176.38 91.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.826 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.688 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 172.53 -152.29 16.31 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.667 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.3 t -127.0 141.71 51.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.856 0.36 . . . . 0.0 110.805 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -59.39 -30.16 68.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.891 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.15 -31.47 30.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.906 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -69.12 -48.86 61.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.923 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.556 HD11 ' OD1' ' A' ' 13' ' ' ASP . 3.6 mp -59.24 -31.2 68.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.882 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.307 -0.854 . . . . 0.0 110.848 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.844 0.354 . . . . 0.0 111.099 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.529 HD23 ' HA ' ' A' ' 76' ' ' ASN . 2.6 mp -145.12 146.06 31.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.823 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.465 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -59.45 -177.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.836 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.9 mp -128.76 123.01 58.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.039 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -121.05 166.02 14.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.79 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 41.3 p -134.4 150.72 50.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.985 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.414 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 2.6 t -105.49 178.32 4.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.005 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.21 -47.11 65.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.807 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -68.46 -31.94 71.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.742 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.539 ' CZ ' HD13 ' A' ' 80' ' ' LEU . 85.2 t80 -64.02 -41.84 97.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.892 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -60.3 -52.71 64.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.935 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.2 ptmt -69.71 -12.41 61.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.26 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.659 ' OD1' HD21 ' A' ' 89' ' ' LEU . 1.8 m-20 -90.05 -24.22 21.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.247 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.925 HD23 HD11 ' A' ' 24' ' ' LEU . 1.2 tp -89.97 -44.68 9.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.384 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.455 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -53.51 -24.64 13.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.413 -179.571 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 29.4 mm -80.67 -28.88 11.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.223 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.71 HD11 ' HA2' ' A' ' 84' ' ' GLY . 25.3 mt -87.06 -38.4 16.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.071 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.545 HG23 ' HA ' ' A' ' 23' ' ' ASP . 12.1 p -59.05 -40.32 80.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.04 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -30.0 69.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.836 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -100.64 28.26 5.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.888 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.68 102.79 0.55 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.673 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.405 ' HB3' ' HA ' ' A' ' 18' ' ' VAL . 53.5 t80 -175.67 -40.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.713 0.292 . . . . 0.0 110.878 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.545 ' HA ' HG23 ' A' ' 18' ' ' VAL . 0.5 OUTLIER 59.41 173.9 0.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.912 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.925 HD11 HD23 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -117.86 17.05 14.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.081 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.02 -33.54 16.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.875 0.369 . . . . 0.0 110.871 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.78 HD12 ' N ' ' A' ' 27' ' ' LEU . 4.3 pp -64.66 -29.62 70.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.977 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.78 ' N ' HD12 ' A' ' 26' ' ' LEU . 3.3 tp -71.75 -36.36 70.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.903 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.488 ' O ' HG22 ' A' ' 31' ' ' VAL . 5.1 m-85 -76.47 -27.65 56.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.874 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.84 -31.57 20.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.986 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.583 HG12 ' O ' ' A' ' 26' ' ' LEU . 14.7 p -78.36 -5.0 7.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.614 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.488 HG22 ' O ' ' A' ' 28' ' ' TYR . 30.0 m -53.03 -42.91 46.41 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-O 120.89 0.376 . . . . 0.0 111.361 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.434 ' N ' HG23 ' A' ' 31' ' ' VAL . . . -63.85 -26.98 70.52 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.432 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.2 m-20 -85.61 -22.4 28.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.632 0.253 . . . . 0.0 111.129 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 75.2 mt -76.54 -48.64 18.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.902 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.09 -36.02 82.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.213 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.5 p -88.16 -42.69 12.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.985 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.629 ' HA ' HD11 ' A' ' 40' ' ' LEU . 15.4 mt-10 61.88 57.29 2.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.876 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -88.72 -51.89 0.38 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.412 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -79.95 -92.93 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.221 1.947 . . . . 0.0 112.703 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.629 HD11 ' HA ' ' A' ' 37' ' ' GLU . 1.0 OUTLIER 55.86 -178.24 0.04 OUTLIER 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.826 0.346 . . . . 0.0 111.074 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.544 ' HB3' ' HD2' ' A' ' 44' ' ' TYR . . . -128.32 106.46 19.47 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.04 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.97 -7.14 20.76 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.425 2.083 . . . . 0.0 112.793 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.2 32.0 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.697 0.284 . . . . 0.0 111.013 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.544 ' HD2' ' HB3' ' A' ' 41' ' ' ALA . 18.1 m-85 -139.95 -79.66 0.3 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.932 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -177.98 37.67 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.922 0.391 . . . . 0.0 110.893 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.405 ' O ' ' CG ' ' A' ' 47' ' ' HIS . 43.3 p-10 -71.99 75.14 0.92 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.876 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.405 ' CG ' ' O ' ' A' ' 46' ' ' ASP . 1.4 m-70 -178.16 170.0 0.89 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.905 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -52.33 -176.04 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.599 2.199 . . . . 0.0 112.231 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.509 HD12 ' N ' ' A' ' 49' ' ' LEU . 4.6 mp -109.02 -75.12 0.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.944 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.9 mtmt 174.01 -172.95 0.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.903 0.382 . . . . 0.0 110.744 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 87.16 -149.23 21.93 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.457 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.27 30.91 3.1 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.54 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.3 mp -93.52 -46.51 7.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.836 0.351 . . . . 0.0 110.887 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.87 29.37 18.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.888 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.91 -41.52 2.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.72 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -80.61 129.32 34.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.855 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -148.22 133.31 18.26 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.728 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.555 ' HG3' HG22 ' A' ' 68' ' ' VAL . 3.8 tt0 -109.76 146.37 35.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.97 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 21.2 m -149.69 141.95 24.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.772 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.533 ' CE1' HD23 ' A' ' 66' ' ' LEU . 10.0 m-70 -101.97 92.72 4.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.008 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.596 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.0 pp -62.2 -39.88 94.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.755 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.612 ' HD3' HD13 ' A' ' 65' ' ' LEU . 4.1 mttp -104.53 169.14 7.54 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.741 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 56.8 Cg_endo -71.1 -7.91 22.41 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.559 2.172 . . . . 0.0 112.95 -179.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.712 ' C ' HD12 ' A' ' 65' ' ' LEU . 1.1 m-20 -150.6 45.01 0.86 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.864 0.364 . . . . 0.0 111.156 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.712 HD12 ' C ' ' A' ' 64' ' ' ASP . 5.3 mp -158.91 130.21 6.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.152 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.673 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -94.24 -179.41 4.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.28 179.532 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.833 HD21 HD23 ' A' ' 80' ' ' LEU . 6.4 tt -170.09 102.24 0.29 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.836 0.35 . . . . 0.0 111.383 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.555 HG22 ' HG3' ' A' ' 58' ' ' GLU . 22.8 t -95.23 137.33 23.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.444 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.617 ' HA ' HG23 ' A' ' 81' ' ' VAL . 6.1 p90 -147.05 170.55 16.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.982 0.42 . . . . 0.0 111.405 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -143.03 114.2 7.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.553 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.488 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.4 mp -84.89 135.52 24.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.933 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.98 103.79 12.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.85 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.77 -19.85 62.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.153 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -51.65 -36.51 46.45 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.861 0.362 . . . . 0.0 111.042 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -144.99 18.56 1.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.193 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.529 ' HA ' HD23 ' A' ' 2' ' ' LEU . 12.8 m120 47.27 77.24 0.09 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.829 0.347 . . . . 0.0 111.188 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.465 HG23 ' HB ' ' A' ' 3' ' ' THR . 63.7 m -137.39 144.04 42.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.102 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.47 HD13 HD11 ' A' ' 71' ' ' ILE . 38.1 tp -98.61 91.09 4.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.451 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.414 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.1 t80 -89.8 105.82 18.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.888 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.833 HD23 HD21 ' A' ' 67' ' ' LEU . 3.0 mt -64.75 169.26 5.22 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.774 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.617 HG23 ' HA ' ' A' ' 69' ' ' TYR . 74.7 t -136.8 -71.48 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.086 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -118.67 168.44 10.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.932 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.452 HD22 HD12 ' A' ' 14' ' ' LEU . 5.5 tt -176.61 117.37 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.923 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.71 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 158.14 -147.86 16.32 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.497 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.8 136.89 29.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.821 0.343 . . . . 0.0 110.917 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.38 -30.4 66.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.909 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.7 p -76.75 -30.77 56.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.859 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -80.27 -54.84 5.36 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.927 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.659 HD21 ' OD1' ' A' ' 13' ' ' ASP . 4.5 mp -60.09 -64.92 0.78 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.772 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.821 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.791 0.329 . . . . 0.0 111.115 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.5 mp -131.91 158.06 42.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.926 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.663 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -68.76 -173.41 0.46 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.792 179.986 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.0 mp -130.2 136.76 57.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.075 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -139.63 161.09 38.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.753 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.6 p -135.36 155.43 50.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.082 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 8.7 p -110.89 -168.7 1.34 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.795 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -81.14 -42.47 20.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.942 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 71.0 mttt -72.25 -41.05 67.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.892 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.808 ' CE1' HD21 ' A' ' 14' ' ' LEU . 14.2 t80 -59.86 -34.39 73.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.805 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -65.61 -31.12 71.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.6 mtpp -87.36 -8.04 57.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.389 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.608 ' CG ' HD21 ' A' ' 89' ' ' LEU . 3.8 m-20 -88.98 -29.48 19.48 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.792 0.329 . . . . 0.0 111.128 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.808 HD21 ' CE1' ' A' ' 10' ' ' PHE . 21.9 mt -84.08 -35.3 23.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.076 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.402 ' HE3' HD11 ' A' ' 16' ' ' ILE . 27.7 pttt -58.7 -29.85 66.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.172 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.402 HD11 ' HE3' ' A' ' 15' ' ' LYS . 29.3 mm -79.89 -39.16 19.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.282 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.57 ' CD2' HD21 ' A' ' 65' ' ' LEU . 3.6 mp -72.31 -41.04 67.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.014 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.407 HG12 ' O ' ' A' ' 14' ' ' LEU . 13.6 p -63.74 -30.14 49.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.232 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -76.55 -33.9 58.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.824 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -83.15 -59.27 2.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.765 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -170.07 63.11 0.17 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.378 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.42 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 1.3 t80 -151.21 172.09 16.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.81 0.338 . . . . 0.0 110.89 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -151.42 144.1 24.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.826 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.0 mp -71.25 -23.78 62.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.043 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -51.73 68.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.073 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.42 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 2.4 pp -58.75 -31.75 68.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.007 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.508 ' HA ' HG12 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -63.24 -31.24 72.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.894 179.914 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -80.72 -26.65 37.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.7 mtpp -87.57 -29.41 21.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.973 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.508 HG12 ' HA ' ' A' ' 27' ' ' LEU . 14.8 p -76.12 -16.88 15.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.471 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.8 t -48.39 -42.06 11.6 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 120.83 0.348 . . . . 0.0 111.356 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.83 -27.5 64.39 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.339 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.9 m-20 -85.32 -22.44 28.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.819 0.343 . . . . 0.0 111.039 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.6 mt -74.26 -33.4 63.28 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.85 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.88 -43.27 62.72 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.087 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 73.3 p -86.26 -39.29 16.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.87 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 60.85 67.96 0.78 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.846 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.93 -53.57 0.26 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.255 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -82.82 -86.58 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 122.287 1.991 . . . . 0.0 112.545 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.45 ' N ' HD12 ' A' ' 40' ' ' LEU . 6.8 mp 55.38 39.44 31.2 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.786 0.327 . . . . 0.0 111.148 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 60.54 100.31 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.206 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.35 62.24 2.73 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.465 2.11 . . . . 0.0 112.404 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.12 -44.6 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.967 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -82.33 -29.68 30.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.9 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.3 mmpp? 62.08 118.7 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.032 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -81.94 154.73 25.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.716 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 12.3 p80 177.09 156.72 0.46 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.869 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.05 159.09 45.04 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.621 2.214 . . . . 0.0 112.419 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.2 mt -65.26 -67.22 0.46 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.848 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.668 ' HB2' HD11 ' A' ' 53' ' ' LEU . 7.8 mttm -146.12 104.34 3.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.95 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -65.91 123.6 24.48 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.515 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 111.9 33.16 2.26 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.584 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.668 HD11 ' HB2' ' A' ' 50' ' ' LYS . 0.9 OUTLIER -177.76 -39.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.815 0.341 . . . . 0.0 110.981 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.584 ' HG3' HD12 ' A' ' 53' ' ' LEU . 83.3 mttt -134.45 138.0 44.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.92 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -98.39 28.47 4.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.999 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.514 ' CE2' HG21 ' A' ' 81' ' ' VAL . 1.8 m-85 -80.72 174.42 11.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.827 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -175.53 125.73 0.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.837 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -116.03 130.56 56.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.782 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.65 ' SG ' HD23 ' A' ' 67' ' ' LEU . 28.5 p -134.3 -175.68 3.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.971 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.544 ' CE1' HD23 ' A' ' 66' ' ' LEU . 85.8 m-70 -134.67 80.37 1.85 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.014 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.808 HD23 HD22 ' A' ' 67' ' ' LEU . 3.3 pp -57.34 -31.24 65.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.122 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.414 ' HB2' HD12 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -135.6 151.63 74.78 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.984 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -51.81 133.31 44.84 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.522 2.148 . . . . 0.0 112.34 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 59.41 25.55 14.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.011 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.57 HD21 ' CD2' ' A' ' 17' ' ' LEU . 3.3 mp -134.35 117.28 16.19 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.787 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.71 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.1 OUTLIER -90.03 179.35 5.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.717 -179.968 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.966 HD11 HD12 ' A' ' 80' ' ' LEU . 37.8 tp -167.39 100.35 0.51 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.372 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' A' ' 81' ' ' VAL . 41.4 t -95.3 123.33 47.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.893 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.421 ' HA ' HG23 ' A' ' 81' ' ' VAL . 10.3 p90 -138.78 159.5 41.97 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.976 0.417 . . . . 0.0 111.463 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -136.96 118.28 14.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.519 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.489 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.4 mp -84.94 123.63 39.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.921 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.401 ' CD ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -97.03 100.52 12.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.699 179.703 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.89 -22.62 38.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.112 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -49.57 -36.06 22.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.844 0.354 . . . . 0.0 111.049 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -145.39 18.29 1.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.257 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 47.23 71.01 0.35 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.804 0.335 . . . . 0.0 111.217 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.663 HG23 ' HB ' ' A' ' 3' ' ' THR . 97.6 m -130.19 148.68 52.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.065 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.418 ' CD1' HD11 ' A' ' 71' ' ' ILE . 65.0 tp -102.13 90.5 3.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.541 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.432 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 3.5 t80 -89.93 115.77 27.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.017 -179.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.966 HD12 HD11 ' A' ' 67' ' ' LEU . 3.3 mm? -68.97 168.14 14.35 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.706 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.514 HG21 ' CE2' ' A' ' 56' ' ' PHE . 43.9 t -141.0 -58.75 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.98 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 41.5 mmm-85 -131.54 165.49 23.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.842 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.873 HD12 HD13 ' A' ' 67' ' ' LEU . 5.9 tt -177.05 139.1 0.26 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.948 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.71 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 118.85 -143.35 17.39 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.59 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.9 t -127.4 147.74 50.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.806 0.336 . . . . 0.0 110.861 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -59.3 -30.78 68.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.915 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.3 m -87.22 -31.52 20.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -67.7 -31.4 71.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.9 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.608 HD21 ' CG ' ' A' ' 13' ' ' ASP . 0.3 OUTLIER -60.12 -64.16 1.05 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 179.924 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.226 -0.892 . . . . 0.0 110.866 179.999 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.905 0.383 . . . . 0.0 111.223 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.506 HD12 ' N ' ' A' ' 2' ' ' LEU . 0.6 OUTLIER -122.87 141.51 51.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.008 -180.0 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.481 HG22 ' H ' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -56.81 -170.45 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.863 179.872 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.481 ' H ' HG22 ' A' ' 3' ' ' THR . 4.0 mp -130.97 136.22 58.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.89 0.376 . . . . 0.0 111.187 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -128.31 170.05 13.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.644 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.6 p -137.68 165.66 25.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.854 0.359 . . . . 0.0 111.075 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.3 -175.3 3.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.913 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.13 -53.08 13.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.964 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -62.41 -36.29 81.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.913 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -59.56 -33.17 71.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.93 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -70.57 -40.6 73.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.849 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.1 mttt -78.31 -4.94 50.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.337 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.488 ' OD1' HD11 ' A' ' 89' ' ' LEU . 1.6 m-20 -90.08 -56.54 3.18 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.829 0.347 . . . . 0.0 111.173 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -54.67 -36.8 65.0 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.224 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.8 ptpt -58.9 -30.29 67.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.998 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.1 mm -82.58 -30.48 9.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.249 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.429 HD11 ' HA2' ' A' ' 84' ' ' GLY . 69.5 mt -81.78 -39.5 24.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.949 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.7 p -59.74 -33.47 52.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.08 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.1 tttp -78.88 -30.06 44.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.991 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -98.33 29.07 3.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.93 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.09 95.42 0.89 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.603 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.685 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 15.6 t80 -176.66 101.52 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.837 0.351 . . . . 0.0 110.956 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.598 ' C ' HD22 ' A' ' 24' ' ' LEU . 1.9 t0 -60.2 -167.87 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.863 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.598 HD22 ' C ' ' A' ' 23' ' ' ASP . 3.8 mm? -118.7 -39.92 2.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.997 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.3 mttp -66.67 -27.06 67.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.181 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.89 ' O ' HG23 ' A' ' 30' ' ' VAL . 3.9 pp -57.92 -41.85 83.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.045 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.725 ' O ' HG13 ' A' ' 31' ' ' VAL . 2.8 tp -64.46 -30.05 71.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.038 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.655 ' O ' HG22 ' A' ' 31' ' ' VAL . 17.7 m-85 -73.37 -27.63 61.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.144 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.86 -30.63 18.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.054 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.89 HG23 ' O ' ' A' ' 26' ' ' LEU . 34.8 t -75.01 -18.06 16.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.384 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.725 HG13 ' O ' ' A' ' 27' ' ' LEU . 28.1 m -49.47 -27.97 3.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.828 0.347 . . . . 0.0 111.441 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.555 ' O ' HG23 ' A' ' 36' ' ' THR . . . -72.34 -27.39 69.92 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.606 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -86.97 -28.53 22.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.759 0.314 . . . . 0.0 111.077 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.477 HD22 HD13 ' A' ' 67' ' ' LEU . 36.3 mt -65.11 -44.61 88.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.981 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.84 -35.96 67.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.32 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.555 HG23 ' O ' ' A' ' 32' ' ' GLY . 78.0 p -77.24 -45.12 27.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.887 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.516 ' HB3' HD11 ' A' ' 40' ' ' LEU . 18.5 mt-10 60.81 55.97 3.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.794 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.409 ' N ' ' CD ' ' A' ' 39' ' ' PRO . 0.1 OUTLIER -91.72 -52.22 0.29 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.097 -179.799 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.409 ' CD ' ' N ' ' A' ' 38' ' ' GLN . 47.2 Cg_endo -83.48 -78.31 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.422 2.081 . . . . 0.0 112.736 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.593 HD22 ' HB2' ' A' ' 59' ' ' CYS . 0.9 OUTLIER 57.7 24.75 10.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.728 0.299 . . . . 0.0 111.01 -179.89 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.24 138.52 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.096 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.71 -20.88 15.1 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.583 2.189 . . . . 0.0 112.538 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.442 ' HG2' ' CD2' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -97.67 31.58 2.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.11 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.442 ' CD2' ' HG2' ' A' ' 43' ' ' LYS . 72.5 m-85 -157.92 -70.88 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.066 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 5.9 mmmt 63.55 139.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.933 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -73.58 161.94 29.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.939 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -165.08 154.26 11.23 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.867 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.17 160.07 43.83 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.57 2.18 . . . . 0.0 112.324 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.533 HD13 ' HB3' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -97.59 -58.86 1.9 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.836 -179.882 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.8 mtmt -128.87 157.32 41.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.972 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -95.67 122.9 7.46 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.45 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 135.81 -29.15 2.89 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.453 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -131.91 -47.26 0.94 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.806 0.336 . . . . 0.0 110.871 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.7 mttt 58.17 30.38 19.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.912 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.18 -47.94 22.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.842 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.533 ' HB3' HD13 ' A' ' 49' ' ' LEU . 4.8 m-85 -87.68 147.92 25.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.765 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -160.79 147.0 14.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.95 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.631 ' OE2' HD22 ' A' ' 66' ' ' LEU . 54.0 tt0 -127.48 117.63 22.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.933 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.593 ' HB2' HD22 ' A' ' 40' ' ' LEU . 30.3 p -115.02 177.48 4.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.843 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -124.05 90.05 3.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.893 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.882 HD23 HD12 ' A' ' 67' ' ' LEU . 3.8 pp -65.82 -32.43 73.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.883 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.511 ' HB2' HD12 ' A' ' 61' ' ' LEU . 1.4 mttp -139.16 165.18 33.89 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.809 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -62.01 130.58 31.38 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.54 2.16 . . . . 0.0 112.153 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 61.14 31.03 19.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.839 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -140.14 118.16 11.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.812 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.7 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -97.6 177.64 5.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.616 179.916 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.96 HD21 HD12 ' A' ' 80' ' ' LEU . 3.9 tt -165.37 102.35 0.73 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.12 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.409 ' O ' ' N ' ' A' ' 81' ' ' VAL . 37.5 t -94.65 124.16 47.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.167 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.653 ' HD2' HD22 ' A' ' 67' ' ' LEU . 5.6 p90 -141.18 157.94 44.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.933 0.397 . . . . 0.0 111.244 -179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -137.26 114.04 10.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.75 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.502 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.3 mp -84.98 131.99 32.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.88 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.424 ' HB2' ' CG ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -106.55 102.42 11.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.801 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.1 mttp -59.33 -23.43 62.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.491 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.424 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 1.1 pt20 -51.26 -33.49 28.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.73 0.3 . . . . 0.0 111.141 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -145.51 17.2 1.49 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.482 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 m120 46.53 72.61 0.22 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.894 0.378 . . . . 0.0 111.256 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.411 ' HB ' ' CG ' ' A' ' 72' ' ' LYS . 85.1 m -131.18 142.93 50.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.921 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.435 ' CD1' HD11 ' A' ' 71' ' ' ILE . 64.4 tp -97.06 90.29 5.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.525 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -91.68 106.35 18.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.899 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.96 HD12 HD21 ' A' ' 67' ' ' LEU . 3.6 mm? -65.43 -177.57 0.43 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.675 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.409 ' N ' ' O ' ' A' ' 68' ' ' VAL . 45.6 t -153.25 -62.99 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.165 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -127.54 166.49 17.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.868 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.568 HD12 ' HG ' ' A' ' 67' ' ' LEU . 1.4 tt -178.26 132.6 0.14 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.856 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.7 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 129.76 -145.82 16.8 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.495 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.6 t -129.41 148.23 51.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.845 0.355 . . . . 0.0 110.871 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -64.34 -39.08 93.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 45.2 p -66.43 -31.23 71.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.865 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.68 -53.04 24.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.893 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.488 HD11 ' OD1' ' A' ' 13' ' ' ASP . 3.9 mp -60.19 -50.75 72.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.857 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.906 0.384 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -145.62 149.26 34.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.899 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.584 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -63.73 -178.88 0.33 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.855 -179.951 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.2 mp -131.46 114.58 26.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.116 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -106.57 168.37 9.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.733 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 76.6 p -137.28 148.96 46.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.067 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.417 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 28.9 t -103.55 -167.94 1.44 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.833 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -84.79 -47.75 10.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.803 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -70.51 -28.08 64.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.976 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -56.98 -30.87 64.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.99 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -75.44 -46.81 30.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.926 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.1 mtpp -66.86 -21.91 66.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.173 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.22 -28.67 23.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.817 0.341 . . . . 0.0 111.099 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.557 ' O ' HG12 ' A' ' 18' ' ' VAL . 0.2 OUTLIER -79.28 -34.9 42.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.037 -179.883 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -56.81 -24.53 51.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.228 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.1 mm -80.36 -45.88 21.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.413 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.487 HD21 HD11 ' A' ' 65' ' ' LEU . 3.8 mp -72.65 -44.47 61.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.125 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.557 HG12 ' O ' ' A' ' 14' ' ' LEU . 13.3 p -56.4 -30.04 29.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.224 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.15 -40.19 22.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.997 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -70.59 -62.61 1.32 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.946 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -178.86 75.35 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.51 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.507 ' CE1' HD21 ' A' ' 26' ' ' LEU . 86.0 t80 -153.03 137.51 16.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.805 0.336 . . . . 0.0 110.869 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.24 119.49 39.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.79 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.596 ' H ' HD23 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -55.46 -23.67 26.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.182 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.5 tttm -59.2 -50.24 74.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.027 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.507 HD21 ' CE1' ' A' ' 22' ' ' PHE . 2.0 pp -57.86 -28.54 64.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.096 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.527 ' HA ' HG12 ' A' ' 30' ' ' VAL . 4.5 tt -64.88 -26.68 68.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.998 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.683 ' O ' HG12 ' A' ' 31' ' ' VAL . 2.4 m-85 -80.38 -28.09 38.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.172 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -87.53 -29.35 21.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.195 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.527 HG12 ' HA ' ' A' ' 27' ' ' LEU . 15.0 p -75.31 -25.73 18.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.328 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.683 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.5 p -47.23 -32.86 2.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.496 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.36 -26.44 74.56 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.454 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -88.5 -23.78 23.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.759 0.314 . . . . 0.0 111.139 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 34.1 mt -69.34 -38.12 78.0 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.922 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.64 -12.16 59.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.623 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.1 p -107.68 -44.55 4.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.839 0.352 . . . . 0.0 110.99 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.657 ' HB3' HD11 ' A' ' 40' ' ' LEU . 3.0 mt-10 60.8 60.78 1.81 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.697 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.402 ' N ' ' CD ' ' A' ' 39' ' ' PRO . 1.1 mt-30 -91.64 -52.05 0.29 Allowed Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.519 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.402 ' CD ' ' N ' ' A' ' 38' ' ' GLN . 65.4 Cg_endo -80.29 -90.64 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 122.348 2.032 . . . . 0.0 112.988 -179.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.657 HD11 ' HB3' ' A' ' 37' ' ' GLU . 0.9 OUTLIER 62.41 -167.54 0.2 Allowed 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.761 0.315 . . . . 0.0 110.716 -179.609 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -112.38 137.41 21.57 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.997 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -73.58 -29.11 11.22 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.526 2.151 . . . . 0.0 112.37 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.71 -29.77 45.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.025 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -97.39 -53.3 3.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.995 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.52 149.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.833 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -97.28 147.31 24.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.86 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -172.82 159.71 3.72 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.953 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -56.34 177.19 0.16 Allowed 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.646 2.231 . . . . 0.0 112.377 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.478 HD13 ' HB3' ' A' ' 56' ' ' PHE . 11.1 mp -99.24 -54.96 2.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.838 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.2 mtmm -139.96 -176.71 4.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.854 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -91.66 -170.29 41.88 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.486 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 87.86 -71.89 2.53 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.461 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.602 HD12 ' HB2' ' A' ' 55' ' ' ASP . 0.2 OUTLIER -100.94 -37.63 8.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.794 0.33 . . . . 0.0 110.905 -179.853 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.57 28.07 13.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.02 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.602 ' HB2' HD12 ' A' ' 53' ' ' LEU . 0.7 OUTLIER -86.7 -45.93 10.51 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.719 179.885 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.478 ' HB3' HD13 ' A' ' 49' ' ' LEU . 45.7 m-85 -60.27 147.82 38.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.752 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.9 mtt85 -159.28 125.14 4.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.916 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -112.6 108.15 17.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.889 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.5 p -105.36 172.45 6.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.985 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 13.3 m-70 -124.52 83.2 2.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.84 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.76 HD23 HD12 ' A' ' 67' ' ' LEU . 2.2 pp -55.73 -40.78 72.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.032 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.655 ' CG ' HD12 ' A' ' 61' ' ' LEU . 9.1 mmtm -117.54 155.87 49.91 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -48.23 -25.85 7.47 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.733 2.289 . . . . 0.0 112.627 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.679 ' O ' HD12 ' A' ' 65' ' ' LEU . 0.8 OUTLIER -141.04 75.36 1.5 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.816 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.679 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.2 OUTLIER -174.54 119.6 0.23 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.079 -179.85 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.795 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.1 OUTLIER -89.89 151.87 21.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.357 179.708 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.86 HD21 HD23 ' A' ' 80' ' ' LEU . 2.1 tt -145.3 97.58 3.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.919 0.39 . . . . 0.0 111.394 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.546 HG23 ' HB3' ' A' ' 82' ' ' ARG . 37.7 t -92.47 122.0 43.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.785 178.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.649 ' HD2' HD22 ' A' ' 67' ' ' LEU . 5.8 p90 -140.38 162.92 34.15 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.996 0.427 . . . . 0.0 111.412 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -144.26 108.08 4.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.575 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.574 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -84.88 133.65 28.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.927 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.35 100.67 10.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.716 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -58.68 -21.77 55.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.343 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -55.0 -29.89 58.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.79 0.329 . . . . 0.0 111.161 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -144.37 16.12 1.67 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.392 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 46.94 72.1 0.27 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.865 0.364 . . . . 0.0 111.251 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.584 HG23 ' HB ' ' A' ' 3' ' ' THR . 99.0 m -134.83 142.51 46.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.946 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.507 HD13 HG23 ' A' ' 31' ' ' VAL . 1.4 tt -99.64 93.11 5.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.726 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 3.6 t80 -92.2 107.62 19.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.877 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.86 HD23 HD21 ' A' ' 67' ' ' LEU . 2.1 mt -67.13 -179.85 1.04 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.563 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.413 ' N ' ' O ' ' A' ' 68' ' ' VAL . 43.9 t -154.25 -56.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.144 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.546 ' HB3' HG23 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -118.81 163.77 16.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.112 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -177.39 101.08 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.849 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.795 ' O ' HD12 ' A' ' 66' ' ' LEU . . . -178.21 169.43 41.17 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.523 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.3 p -95.48 148.81 22.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.8 0.333 . . . . 0.0 110.841 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -68.63 -30.99 69.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.881 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.1 t -70.07 -39.65 75.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.95 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -76.73 -59.04 2.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.882 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.475 HD11 ' HA3' ' A' ' 84' ' ' GLY . 4.4 mp -59.8 -58.25 9.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.911 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.249 -0.882 . . . . 0.0 110.875 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.805 0.336 . . . . 0.0 111.14 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.558 HD13 ' CB ' ' A' ' 78' ' ' LEU . 0.8 OUTLIER -123.07 148.38 45.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.908 -179.98 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.678 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -74.99 -171.14 1.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.013 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.441 ' H ' HG22 ' A' ' 3' ' ' THR . 4.6 mp -137.06 135.89 47.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.042 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -133.58 162.71 31.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.83 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.428 HG22 HD12 ' A' ' 80' ' ' LEU . 41.0 p -138.09 147.82 44.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.988 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -105.44 171.85 7.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.997 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -43.91 87.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.974 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -65.05 -42.65 94.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.885 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.701 ' CE2' HD13 ' A' ' 80' ' ' LEU . 13.3 t80 -59.22 -37.49 77.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.848 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -58.57 -30.49 67.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.825 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.8 mttp -82.11 -23.83 35.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.997 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.496 ' OD2' HD11 ' A' ' 89' ' ' LEU . 1.0 OUTLIER -79.22 -23.81 43.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.159 -179.895 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.59 HD13 ' CE1' ' A' ' 10' ' ' PHE . 2.1 tp -89.96 -39.38 13.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.247 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.3 -30.43 62.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.125 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.9 mm -82.19 -29.26 9.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.128 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.402 HD11 ' HA2' ' A' ' 84' ' ' GLY . 14.1 mt -79.37 -36.94 38.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.015 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.3 p -65.26 -33.99 67.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.058 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -74.13 -31.3 62.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.963 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -87.67 -56.18 3.46 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.904 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -176.83 78.45 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.545 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -158.25 166.77 31.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.795 0.331 . . . . 0.0 110.819 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -130.99 170.95 13.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.928 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.66 -52.37 3.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.916 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.95 -28.91 68.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.974 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.661 ' O ' HD13 ' A' ' 26' ' ' LEU . 3.4 tm? -58.46 -32.52 68.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.893 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.448 ' HA ' HG12 ' A' ' 30' ' ' VAL . 10.0 tt -77.49 -35.45 53.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.101 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.592 ' O ' HG22 ' A' ' 31' ' ' VAL . 6.4 m-85 -76.52 -23.43 53.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.969 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -88.73 -37.45 15.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.879 0.371 . . . . 0.0 111.002 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.448 HG12 ' HA ' ' A' ' 27' ' ' LEU . 12.1 p -66.08 -15.39 18.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.469 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.592 HG22 ' O ' ' A' ' 28' ' ' TYR . 22.5 m -49.25 -39.29 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.13 0 CA-C-O 120.73 0.3 . . . . 0.0 111.325 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.57 -27.3 63.48 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.485 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -89.81 -31.52 17.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.881 0.372 . . . . 0.0 110.91 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' A' ' 31' ' ' VAL . 65.3 mt -62.3 -46.75 87.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.848 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.88 -33.57 74.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.116 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 76.2 p -81.75 -42.27 20.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.987 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.834 ' HB3' HD11 ' A' ' 40' ' ' LEU . 14.2 mt-10 61.62 45.41 8.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.003 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.443 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 2.4 mt-30 -80.83 -52.3 0.89 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.17 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.443 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 50.4 Cg_endo -73.96 -85.5 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.13 1.887 . . . . 0.0 112.659 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.834 HD11 ' HB3' ' A' ' 37' ' ' GLU . 3.8 mt 59.88 22.87 11.88 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.762 0.315 . . . . 0.0 111.233 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 61.71 119.28 0.02 OUTLIER Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.071 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -75.07 59.49 5.25 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.449 2.099 . . . . 0.0 112.428 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.458 ' HG3' ' CE2' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -153.13 -45.22 0.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.93 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.458 ' CE2' ' HG3' ' A' ' 43' ' ' LYS . 14.9 m-85 -97.78 -49.96 4.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.828 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 63.61 126.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.901 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.583 ' HB2' HD13 ' A' ' 40' ' ' LEU . 17.5 t0 -57.97 132.17 52.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.92 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 41.2 p-80 -139.21 148.59 57.74 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.89 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.74 160.94 45.14 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.485 2.123 . . . . 0.0 112.329 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.9 mt -100.92 -175.8 2.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.931 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.8 mtmt -166.56 106.92 0.66 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.885 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 154.37 49.79 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.578 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.57 -23.18 37.33 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.588 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.0 mt -108.56 87.56 2.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.812 0.339 . . . . 0.0 110.829 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -96.5 27.66 3.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.046 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -147.92 27.56 0.96 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.881 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -126.1 153.81 43.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.807 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 29.4 mtt85 -164.0 139.56 6.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.906 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.468 ' HG3' HG22 ' A' ' 68' ' ' VAL . 0.7 OUTLIER -124.78 137.52 54.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.861 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.9 p -140.85 171.62 13.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.894 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.43 ' NE2' HD23 ' A' ' 66' ' ' LEU . 12.1 m-70 -115.69 82.32 1.74 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.828 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.549 ' H ' HD23 ' A' ' 61' ' ' LEU . 1.5 pt? -59.77 -30.41 68.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.032 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.441 ' HB3' HD13 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -136.1 149.99 69.85 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.903 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.605 ' O ' HD12 ' A' ' 65' ' ' LEU . 53.1 Cg_exo -52.31 129.17 30.33 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.583 2.189 . . . . 0.0 112.318 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 62.42 29.96 17.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.931 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.605 HD12 ' O ' ' A' ' 63' ' ' PRO . 2.6 mp -139.72 118.32 12.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.925 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.646 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -89.91 173.07 8.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.535 179.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.476 HD13 HD12 ' A' ' 83' ' ' LEU . 48.0 tp -164.47 99.34 0.81 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.985 0.421 . . . . 0.0 111.474 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.468 HG22 ' HG3' ' A' ' 58' ' ' GLU . 40.0 t -96.76 124.14 49.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.896 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 7.5 p90 -138.48 155.99 47.94 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.034 0.445 . . . . 0.0 111.409 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -130.58 116.07 17.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.455 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.526 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.4 mp -84.85 128.02 39.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.934 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.409 ' HB2' ' CG ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -102.98 101.65 11.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.672 179.818 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.2 mtmt -58.55 -23.15 57.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.255 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.409 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 1.0 OUTLIER -52.9 -32.44 45.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.818 0.342 . . . . 0.0 111.01 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -145.2 16.48 1.53 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.307 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 45.97 71.76 0.27 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.805 0.336 . . . . 0.0 111.448 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.678 HG23 ' HB ' ' A' ' 3' ' ' THR . 98.5 m -131.4 144.73 51.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.145 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.558 ' CB ' HD13 ' A' ' 2' ' ' LEU . 50.8 tp -101.27 89.66 3.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.41 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -89.98 120.79 31.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.804 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.701 HD13 ' CE2' ' A' ' 10' ' ' PHE . 2.2 mt -69.98 179.76 2.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.738 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.423 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 62.1 t -150.28 -66.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.094 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 -127.2 163.07 24.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.993 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.5 HD23 ' N ' ' A' ' 84' ' ' GLY . 5.2 tt -168.86 152.54 5.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.044 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.646 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 121.82 -168.21 14.55 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.47 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 16.0 t -95.51 171.33 8.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.785 0.326 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -80.56 -30.65 37.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.876 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 91.0 p -85.09 -42.65 14.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.016 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -61.55 -38.73 88.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.84 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.496 HD11 ' OD2' ' A' ' 13' ' ' ASP . 3.7 mm? -72.91 -41.03 65.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.88 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.307 -0.854 . . . . 0.0 110.881 -179.985 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.881 0.372 . . . . 0.0 111.119 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -143.51 149.66 37.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.929 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.578 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -60.42 -175.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.865 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -131.1 121.18 48.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.115 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -118.64 167.9 11.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.75 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.471 HG22 ' CE2' ' A' ' 10' ' ' PHE . 59.7 p -142.1 151.1 42.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.963 0.411 . . . . 0.0 110.97 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.407 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 0.3 OUTLIER -112.74 -167.03 1.13 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.98 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.77 -49.32 14.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.856 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.9 mttp -61.22 -31.27 71.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.967 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.616 ' HZ ' HD21 ' A' ' 27' ' ' LEU . 16.2 t80 -71.02 -47.07 60.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.939 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.32 -45.24 94.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.931 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.2 pttt -72.61 -16.04 61.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.375 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -84.43 -29.19 26.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.742 0.306 . . . . 0.0 111.108 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.595 HD23 HD22 ' A' ' 83' ' ' LEU . 9.6 mt -80.24 -36.47 34.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.071 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.8 pttt -58.67 -25.69 63.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.137 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.1 mm -85.13 -29.51 6.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.277 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.753 HD11 ' HA2' ' A' ' 84' ' ' GLY . 7.1 mt -82.89 -37.13 24.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.05 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.4 p -58.21 -30.4 39.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.051 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -30.75 34.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.916 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -98.76 31.04 3.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.86 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.01 94.3 0.75 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.571 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.736 ' CE1' HD11 ' A' ' 26' ' ' LEU . 16.1 t80 -175.13 100.61 0.08 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.737 0.303 . . . . 0.0 110.868 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.22 -177.51 0.53 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.905 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 40.3 mt -110.78 -31.32 7.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.963 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.26 -27.85 66.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.06 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.736 HD11 ' CE1' ' A' ' 22' ' ' PHE . 4.2 pp -57.17 -43.74 82.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.038 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.715 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -59.08 -48.25 82.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.974 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.639 ' O ' HG22 ' A' ' 31' ' ' VAL . 14.6 m-85 -62.23 -20.12 63.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.081 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -88.32 -29.96 19.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.999 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 26' ' ' LEU . 34.0 t -81.97 -26.36 9.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.28 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.676 HG13 ' O ' ' A' ' 27' ' ' LEU . 28.1 m -54.26 -31.65 22.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.285 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.24 -32.17 83.22 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.419 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -90.01 -28.4 19.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.673 0.273 . . . . 0.0 110.85 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 72.1 mt -62.23 -39.73 93.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.898 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.37 -41.13 85.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.103 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.3 p -77.85 -36.61 49.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.893 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.82 ' HA ' HD11 ' A' ' 40' ' ' LEU . 51.2 mt-10 61.25 43.71 10.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.053 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.401 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -92.83 -52.67 0.26 Allowed Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.211 -179.898 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.401 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 72.6 Cg_endo -84.12 -91.57 0.0 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.548 2.165 . . . . 0.0 112.783 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.82 HD11 ' HA ' ' A' ' 37' ' ' GLU . 1.3 mt 57.87 36.27 26.17 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.83 0.348 . . . . 0.0 110.876 -179.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 64.0 132.97 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.026 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -77.87 -1.16 11.34 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.571 2.181 . . . . 0.0 112.825 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.441 ' HG2' ' CD2' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -109.51 16.79 22.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.35 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.441 ' CD2' ' HG2' ' A' ' 43' ' ' LYS . 43.6 m-85 -146.49 -65.9 0.29 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.85 0.357 . . . . 0.0 110.871 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.1 mtpp 62.6 121.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.912 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -57.96 143.77 41.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.991 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.448 ' CG ' ' HD2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -154.61 156.33 31.44 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.797 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.448 ' HD2' ' CG ' ' A' ' 47' ' ' HIS . 43.1 Cg_endo -67.75 166.5 24.07 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.577 2.184 . . . . 0.0 112.332 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.03 -53.41 4.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.816 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -148.35 -177.48 5.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.008 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -110.15 46.09 1.22 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.524 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.17 12.67 6.39 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.751 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.681 HD12 ' H ' ' A' ' 55' ' ' ASP . 0.3 OUTLIER 179.35 -42.34 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.943 0.402 . . . . 0.0 110.863 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? 58.79 29.48 18.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.974 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.681 ' H ' HD12 ' A' ' 53' ' ' LEU . 74.2 m-20 -92.73 -37.35 12.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.802 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -88.42 153.65 21.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.982 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -164.04 147.08 9.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.712 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.529 ' HG3' HG22 ' A' ' 68' ' ' VAL . 4.1 tt0 -131.45 134.2 45.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.993 0.425 . . . . 0.0 111.151 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 25.0 p -125.46 -175.25 3.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.645 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -135.85 81.7 1.9 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.21 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.557 ' H ' HD23 ' A' ' 61' ' ' LEU . 1.3 pt? -59.93 -33.35 71.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.797 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.617 ' CB ' HD12 ' A' ' 65' ' ' LEU . 0.5 OUTLIER -113.6 141.57 26.21 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.341 179.74 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.401 ' HD2' ' HG3' ' A' ' 62' ' ' LYS . 9.4 Cg_endo -52.38 -20.46 11.62 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.651 2.234 . . . . 0.0 112.784 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.603 ' O ' HD23 ' A' ' 65' ' ' LEU . 0.6 OUTLIER -130.25 36.75 3.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.193 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.617 HD12 ' CB ' ' A' ' 62' ' ' LYS . 56.1 mt -151.82 164.86 36.15 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.944 0.402 . . . . 0.0 111.201 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.676 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -126.28 179.81 5.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.125 179.516 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 1.075 HD21 HD12 ' A' ' 80' ' ' LEU . 9.2 tt -170.03 102.92 0.3 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.822 0.344 . . . . 0.0 111.301 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.529 HG22 ' HG3' ' A' ' 58' ' ' GLU . 21.8 t -89.78 138.19 19.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.312 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.6 ' HA ' HG23 ' A' ' 81' ' ' VAL . 14.8 p90 -147.04 177.15 9.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.074 0.464 . . . . 0.0 111.344 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -148.0 123.04 10.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.474 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.525 ' N ' HD13 ' A' ' 71' ' ' ILE . 3.0 mm -84.69 138.41 19.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.342 -179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.412 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -122.77 87.63 2.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.657 179.8 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -22.11 21.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.177 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -46.73 -33.53 4.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.2 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -147.2 20.04 1.23 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.318 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 29.7 m120 48.21 69.33 0.56 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.872 0.368 . . . . 0.0 111.232 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.578 HG23 ' HB ' ' A' ' 3' ' ' THR . 52.2 m -135.1 137.68 43.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.966 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 35.9 tp -94.53 93.22 7.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.591 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.407 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.8 t80 -89.89 111.78 22.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.834 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 1.075 HD12 HD21 ' A' ' 67' ' ' LEU . 3.5 mm? -71.96 171.53 11.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.88 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.6 HG23 ' HA ' ' A' ' 69' ' ' TYR . 66.0 t -137.61 -72.72 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.162 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.0 mmm-85 -116.19 170.56 8.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.922 0.391 . . . . 0.0 111.047 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.872 HD12 HD12 ' A' ' 67' ' ' LEU . 9.4 tt -177.62 135.16 0.18 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.771 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.753 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 146.38 -168.68 27.78 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.558 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -96.47 144.24 26.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.816 0.341 . . . . 0.0 110.812 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -35.41 73.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.948 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 31.9 m -77.01 -47.1 21.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.96 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.46 -51.04 71.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.955 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.36 -31.08 71.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.863 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.846 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.9 mtp . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.799 0.333 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.67 HD22 HD12 ' A' ' 78' ' ' LEU . 0.5 OUTLIER -107.25 -179.07 3.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.867 179.916 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.448 HG22 ' H ' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -120.4 -171.89 2.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.89 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.448 ' H ' HG22 ' A' ' 3' ' ' THR . 4.3 mp -130.76 126.72 60.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.165 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -124.73 166.49 16.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.846 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 71.3 p -142.0 159.68 41.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.962 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -125.49 172.49 9.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.98 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -44.71 96.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.965 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.6 mttm -62.93 -31.25 72.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.769 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.44 ' CZ ' HD13 ' A' ' 14' ' ' LEU . 76.4 t80 -67.94 -34.88 77.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.839 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -69.77 -30.12 67.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.041 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.85 -21.07 55.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.259 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.744 ' OD1' HD21 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -87.44 -46.36 9.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.807 0.337 . . . . 0.0 111.036 -179.854 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.44 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 1.4 tp -63.43 -37.62 87.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.079 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.3 ptpt -57.44 -22.95 46.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.269 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 26.9 mm -85.88 -36.65 10.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.312 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.835 HD11 ' HA2' ' A' ' 84' ' ' GLY . 63.8 mt -78.58 -35.54 45.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.152 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.0 p -58.16 -33.28 46.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.144 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt -74.87 -30.47 61.33 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.921 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -102.38 30.02 4.84 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.856 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.74 92.53 1.01 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.548 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -176.76 94.96 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.796 0.331 . . . . 0.0 110.861 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.12 -179.06 0.7 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.887 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.2 mp -108.08 -31.74 7.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.851 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.42 -26.03 63.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.042 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.644 ' O ' HG23 ' A' ' 30' ' ' VAL . 3.9 pp -56.6 -38.3 71.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.132 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.662 HD21 HD11 ' A' ' 80' ' ' LEU . 4.4 tt -64.1 -37.35 87.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.918 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.656 ' O ' HG12 ' A' ' 31' ' ' VAL . 0.2 OUTLIER -59.63 -27.0 65.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.031 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.68 -31.67 20.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.885 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 26' ' ' LEU . 24.6 t -67.07 -21.76 28.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.342 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.656 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.2 p -49.98 -29.35 5.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.286 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -71.1 -38.54 63.59 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.46 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -79.81 -26.15 40.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.804 0.335 . . . . 0.0 110.911 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.592 ' HG ' HG12 ' A' ' 30' ' ' VAL . 77.6 mt -73.49 -29.06 62.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.946 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.33 -29.72 42.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.251 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.0 p -96.38 -38.88 9.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.048 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.936 ' HA ' HD21 ' A' ' 40' ' ' LEU . 21.4 mt-10 60.89 72.71 0.51 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.792 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.402 ' CB ' ' HD3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -100.08 -54.31 0.17 Allowed Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.634 -179.574 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.402 ' HD3' ' CB ' ' A' ' 38' ' ' GLN . 49.5 Cg_endo -83.69 -79.26 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.305 2.004 . . . . 0.0 113.111 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.936 HD21 ' HA ' ' A' ' 37' ' ' GLU . 1.2 mm? 46.7 40.73 9.11 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.846 0.355 . . . . 0.0 111.444 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.637 ' HB1' ' HD3' ' A' ' 43' ' ' LYS . . . 63.2 127.31 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.254 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 41' ' ' ALA . 25.6 Cg_exo -62.43 -25.63 76.19 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.494 2.129 . . . . 0.0 112.418 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.637 ' HD3' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -76.1 -30.94 58.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.325 -179.671 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -108.15 -62.6 1.43 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.054 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.9 mttt 63.72 31.35 14.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.804 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.7 t70 59.89 161.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.944 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -171.26 161.26 5.28 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.766 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.52 160.92 47.94 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.551 2.167 . . . . 0.0 112.322 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.92 -48.51 3.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.812 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? 60.7 -174.22 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.941 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.67 48.61 5.78 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.477 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.71 28.38 55.01 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.509 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -176.09 92.29 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.866 0.365 . . . . 0.0 110.878 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -86.64 -27.18 23.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.993 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -63.79 -42.29 97.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.888 0.375 . . . . 0.0 110.891 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.407 ' CG ' ' HB3' ' A' ' 70' ' ' GLN . 14.2 m-85 -60.76 156.27 17.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.83 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.565 ' O ' HG13 ' A' ' 68' ' ' VAL . 9.2 mtm-85 -165.78 175.58 8.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.859 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.582 ' HG3' HG22 ' A' ' 68' ' ' VAL . 14.9 tt0 -159.65 118.78 2.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.918 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.2 p -121.71 -176.88 3.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.852 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.524 ' NE2' HD23 ' A' ' 66' ' ' LEU . 7.3 m-70 -133.84 86.21 2.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.899 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.557 HD23 HD12 ' A' ' 67' ' ' LEU . 4.0 pp -59.11 -33.42 70.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.862 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.462 ' HE3' HD13 ' A' ' 65' ' ' LEU . 6.6 mtmt -111.4 167.31 9.25 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.77 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.29 -12.85 37.32 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.501 2.134 . . . . 0.0 112.482 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -154.7 54.42 0.67 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.727 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.462 HD13 ' HE3' ' A' ' 62' ' ' LYS . 0.2 OUTLIER -151.04 125.69 9.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.908 -179.824 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.77 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -91.87 161.53 14.8 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.612 179.709 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.557 HD12 HD23 ' A' ' 61' ' ' LEU . 5.7 tt -160.5 94.1 1.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.911 0.386 . . . . 0.0 111.112 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.582 HG22 ' HG3' ' A' ' 58' ' ' GLU . 34.7 t -89.96 136.33 24.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.341 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -154.39 154.03 32.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.852 0.358 . . . . 0.0 111.272 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.407 ' HB3' ' CG ' ' A' ' 56' ' ' PHE . 0.0 OUTLIER -133.79 123.01 24.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.783 179.917 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.541 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -88.42 126.81 41.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.784 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.401 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -96.59 99.7 11.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.681 179.702 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.69 -23.05 26.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.204 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 -50.97 -34.63 29.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.909 0.385 . . . . 0.0 111.047 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -143.89 16.82 1.77 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.202 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 m120 47.62 68.74 0.61 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.757 0.313 . . . . 0.0 111.343 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.401 ' HB ' ' CG ' ' A' ' 72' ' ' LYS . 97.9 m -128.32 138.68 52.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.052 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.67 HD12 HD22 ' A' ' 2' ' ' LEU . 1.2 tt -95.74 92.06 6.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.721 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.413 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 3.9 t80 -91.48 118.03 30.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.882 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.662 HD11 HD21 ' A' ' 27' ' ' LEU . 4.8 mt -76.14 179.38 5.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.69 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.406 ' N ' ' O ' ' A' ' 68' ' ' VAL . 90.9 t -150.36 -73.89 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.113 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.504 ' HB2' HG23 ' A' ' 68' ' ' VAL . 9.4 mtp85 -98.03 167.86 10.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.956 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.567 HD12 HD12 ' A' ' 17' ' ' LEU . 0.3 OUTLIER -178.3 90.14 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.876 179.974 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.835 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 176.49 175.74 44.08 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.402 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.9 t -98.01 151.58 20.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.901 0.381 . . . . 0.0 110.842 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -68.04 -47.58 68.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.922 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 29.7 p -60.54 -31.89 70.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.858 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.86 -60.52 2.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.872 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.744 HD21 ' OD1' ' A' ' 13' ' ' ASP . 3.8 mp -60.22 -32.97 71.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.887 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.219 -0.895 . . . . 0.0 110.854 -179.96 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 ttt . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.832 0.348 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.536 ' N ' HD23 ' A' ' 2' ' ' LEU . 0.2 OUTLIER -107.73 133.64 51.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.891 179.972 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -178.52 0.05 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.964 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.407 HD12 ' N ' ' A' ' 4' ' ' ILE . 4.3 mp -127.81 120.93 55.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.132 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -112.56 165.5 12.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.735 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 71.6 p -134.47 149.65 50.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.056 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.416 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 1.4 t -105.43 -172.24 2.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.936 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -75.96 -54.72 6.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.821 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -64.46 -33.17 75.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.799 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.826 ' CZ ' HD13 ' A' ' 80' ' ' LEU . 89.6 t80 -61.93 -30.09 70.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.906 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -68.99 -53.29 21.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.038 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.5 ptmm? -70.84 -10.37 59.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.48 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -85.82 -27.97 24.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.713 0.292 . . . . 0.0 110.946 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 14' ' ' LEU . 3.1 tp -83.44 -34.79 25.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.058 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.9 pttt -59.02 -29.24 67.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.169 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.2 mm -76.08 -39.46 36.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.327 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.674 HD11 ' HA2' ' A' ' 84' ' ' GLY . 10.7 mt -70.76 -44.22 67.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.014 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.1 p -59.76 -28.42 40.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.066 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -78.44 -30.51 47.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.887 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -87.27 -39.8 15.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.966 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 159.56 76.14 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.601 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -147.05 165.84 28.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.808 0.337 . . . . 0.0 110.862 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -125.3 165.98 17.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.963 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.9 mp -90.28 -54.25 4.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.8 mmtt -58.24 -22.96 54.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.1 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.574 ' O ' HG23 ' A' ' 30' ' ' VAL . 3.0 tm? -54.21 -52.74 60.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.033 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.6 -30.65 70.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.96 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -73.24 -26.45 61.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.085 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.23 -33.79 24.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.005 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 26' ' ' LEU . 41.0 t -71.59 -16.82 19.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.447 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.2 t -49.53 -28.33 3.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 120.828 0.347 . . . . 0.0 111.26 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -73.5 -26.72 69.2 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.42 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -90.11 -29.3 18.41 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.758 0.313 . . . . 0.0 110.857 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.3 mt -66.04 -37.92 87.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.904 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.47 -31.61 60.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.111 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 43.4 p -82.51 -44.03 16.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.853 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.639 ' HA ' HD11 ' A' ' 40' ' ' LEU . 16.8 mt-10 61.29 51.9 4.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.945 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -93.55 -53.02 0.25 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.139 -179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -85.12 -88.97 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.513 2.142 . . . . 0.0 112.726 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.639 HD11 ' HA ' ' A' ' 37' ' ' GLU . 0.8 OUTLIER 56.17 28.79 13.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.801 0.334 . . . . 0.0 111.127 180.0 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 61.66 116.44 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.053 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -66.85 -26.27 44.8 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.424 2.083 . . . . 0.0 112.324 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.71 -30.82 71.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.986 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -108.71 -59.51 1.87 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.956 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.4 mttm 63.99 134.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.944 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -66.73 155.15 38.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.954 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 10.9 p-80 -171.48 156.18 4.29 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.897 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.48 170.59 10.74 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.616 2.211 . . . . 0.0 112.19 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.5 mt -104.41 -48.06 3.93 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.023 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.61 140.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.874 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 112.77 43.18 0.89 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.415 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.78 -32.93 6.49 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.533 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.1 mt -113.03 62.26 0.64 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.911 0.386 . . . . 0.0 110.803 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -41.6 83.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.98 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -59.67 -31.39 69.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.944 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.553 ' HE2' HG11 ' A' ' 81' ' ' VAL . 2.5 m-85 -74.94 141.72 44.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.858 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.3 mtt180 -156.74 152.91 27.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.849 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -131.39 149.5 52.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.025 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.568 ' SG ' HD23 ' A' ' 67' ' ' LEU . 32.1 p -139.54 -173.25 3.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.778 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 75.9 m-70 -138.86 85.04 2.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.948 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.491 HD23 HD22 ' A' ' 67' ' ' LEU . 2.1 pp -64.81 -41.08 96.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.816 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.432 ' HD3' HD22 ' A' ' 65' ' ' LEU . 8.0 mttt -102.65 166.61 11.65 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.833 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.85 -12.28 34.85 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.576 2.184 . . . . 0.0 112.425 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -154.33 52.05 0.66 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.888 0.375 . . . . 0.0 110.614 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.432 HD22 ' HD3' ' A' ' 62' ' ' LYS . 0.7 OUTLIER -152.6 127.78 9.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.955 -179.705 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.783 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -89.92 166.33 13.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.502 179.7 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.568 HD23 ' SG ' ' A' ' 59' ' ' CYS . 43.9 tp -159.46 98.57 1.41 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.967 0.413 . . . . 0.0 111.614 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.444 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 19.9 t -95.08 124.74 47.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.691 178.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.462 ' CD1' ' CD1' ' A' ' 71' ' ' ILE . 7.8 p90 -141.18 163.39 33.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.128 0.49 . . . . 0.0 111.534 -179.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -141.66 107.62 5.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.399 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.566 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -84.88 146.28 6.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.014 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.17 104.72 10.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.693 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -59.96 -21.02 60.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.176 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.1 tp-100 -52.46 -33.6 45.2 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.104 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -144.32 17.19 1.7 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.268 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 47.38 74.79 0.15 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.894 0.378 . . . . 0.0 111.234 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 82.3 m -134.46 148.72 50.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.996 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.479 ' HB2' HD12 ' A' ' 2' ' ' LEU . 1.2 tt -107.67 93.04 4.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.63 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.416 ' CE1' ' HB2' ' A' ' 7' ' ' SER . 5.7 t80 -89.99 105.74 18.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.991 -179.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.826 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 3.8 mt -65.73 -179.38 0.67 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.521 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.553 HG11 ' HE2' ' A' ' 56' ' ' PHE . 59.9 t -154.81 -59.53 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.24 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.408 ' HB2' ' CG2' ' A' ' 68' ' ' VAL . 0.0 OUTLIER -113.25 165.95 11.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.85 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.497 ' CD2' HD13 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -177.84 99.16 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.963 -179.944 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.783 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 165.29 -161.39 34.8 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.39 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.2 p -123.03 155.51 36.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.751 0.31 . . . . 0.0 110.976 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -69.17 -31.53 70.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.97 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.1 t -74.78 -34.98 62.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.945 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.93 -57.2 4.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.898 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.2 mp -61.04 -70.8 0.16 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.971 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.818 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mmt . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.825 0.345 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.572 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -144.71 145.91 31.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.844 -179.992 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.665 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -80.26 -173.61 4.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.882 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.4 mp -139.9 112.98 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.99 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -112.41 162.45 15.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.749 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.622 HG22 HD12 ' A' ' 80' ' ' LEU . 74.4 p -141.95 143.3 33.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.074 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.27 175.28 9.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.968 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.5 mtmt -64.79 -45.74 85.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.836 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -61.14 -21.71 64.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.092 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CZ ' ' HB2' ' A' ' 83' ' ' LEU . 1.0 OUTLIER -65.31 -32.45 74.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.004 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.12 -44.43 79.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.935 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.23 -8.85 59.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.371 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.14 -27.27 19.72 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.669 0.271 . . . . 0.0 111.257 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.9 -41.71 11.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.462 -179.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.6 pttm -54.67 -24.31 21.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.345 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.2 mm -83.43 -32.16 8.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.108 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.526 HD13 HD21 ' A' ' 65' ' ' LEU . 91.2 mt -82.03 -38.05 25.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.051 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.0 p -59.27 -30.48 44.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.115 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.31 -45.89 24.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.819 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -71.66 -31.6 67.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.82 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 149.56 75.98 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.543 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.718 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 8.2 t80 -153.7 165.46 35.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.876 0.369 . . . . 0.0 110.907 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -145.51 164.5 31.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.821 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.6 mp -94.77 -29.04 14.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.948 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -33.35 69.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.919 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.718 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 4.4 pp -74.1 -30.66 62.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.021 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.468 ' HA ' HG12 ' A' ' 30' ' ' VAL . 7.3 tt -73.78 -25.99 60.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.137 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.607 ' O ' HG22 ' A' ' 31' ' ' VAL . 0.7 OUTLIER -81.01 -28.58 35.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.094 -179.936 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.73 -36.11 17.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.042 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.468 HG12 ' HA ' ' A' ' 27' ' ' LEU . 13.1 p -62.6 -21.12 26.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.392 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.607 HG22 ' O ' ' A' ' 28' ' ' TYR . 27.8 m -47.68 -32.56 2.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.834 0.349 . . . . 0.0 111.462 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.83 -26.52 74.29 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.474 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -89.88 -27.38 19.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.744 0.307 . . . . 0.0 110.967 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 69.2 mt -66.49 -43.93 84.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.015 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.03 -37.43 72.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.276 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 53.3 p -78.7 -41.44 31.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.021 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.817 ' HA ' HD21 ' A' ' 40' ' ' LEU . 9.2 mt-10 62.08 49.95 4.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.87 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.552 ' H ' ' HD2' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -98.76 -61.76 0.11 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.641 -179.827 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.552 ' HD2' ' H ' ' A' ' 38' ' ' GLN . 30.1 Cg_endo -63.66 -85.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.274 1.983 . . . . 0.0 112.958 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.817 HD21 ' HA ' ' A' ' 37' ' ' GLU . 1.1 mm? 47.61 -173.1 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.801 0.334 . . . . 0.0 111.376 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.404 ' HB1' ' HE2' ' A' ' 43' ' ' LYS . . . -105.25 145.64 31.16 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.12 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.408 ' HA ' ' HD2' ' A' ' 45' ' ' LYS . 73.5 Cg_endo -75.72 -28.92 7.62 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.618 2.212 . . . . 0.0 112.352 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.404 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 2.9 pttt -76.71 -27.28 55.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.044 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.501 ' CD2' ' CG ' ' A' ' 60' ' ' HIS . 19.8 m-85 -105.29 -54.6 2.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.926 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HD2' ' HA ' ' A' ' 42' ' ' PRO . 0.0 OUTLIER 62.92 147.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.803 -179.896 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -87.19 134.53 33.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.976 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.416 ' CG ' ' HD2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -173.22 162.44 3.48 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.857 179.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.416 ' HD2' ' CG ' ' A' ' 47' ' ' HIS . 44.0 Cg_endo -67.96 -177.88 1.47 Allowed 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.583 2.189 . . . . 0.0 112.264 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.8 mp -103.76 -69.29 0.81 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.995 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -178.61 159.42 1.13 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.883 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 111.71 -166.57 12.25 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.551 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -110.82 -20.05 7.44 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.643 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.727 HD12 ' H ' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -53.35 -47.02 69.75 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.837 0.351 . . . . 0.0 111.235 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 58.61 29.73 18.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.041 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.727 ' H ' HD12 ' A' ' 53' ' ' LEU . 4.5 m-20 -104.56 -31.46 9.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.804 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.422 ' CE2' HG21 ' A' ' 81' ' ' VAL . 7.8 m-85 -89.89 137.42 32.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.844 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.3 mtt180 -154.34 148.64 26.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.862 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.437 ' HG3' HG22 ' A' ' 68' ' ' VAL . 30.9 tt0 -118.2 150.04 40.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.04 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 30.4 p -148.47 151.41 35.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.857 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.501 ' CG ' ' CD2' ' A' ' 44' ' ' TYR . 17.2 m-70 -107.83 92.42 4.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.899 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.754 HD12 ' HB2' ' A' ' 62' ' ' LYS . 4.3 pp -68.04 -30.87 70.19 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.782 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.754 ' HB2' HD12 ' A' ' 61' ' ' LEU . 33.2 tptt -140.24 139.55 21.23 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.61 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_exo -43.44 132.96 7.07 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.565 2.177 . . . . 0.0 112.419 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 65.87 25.58 11.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.799 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.526 HD21 HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -145.81 120.0 9.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.712 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.478 HD11 ' HA ' ' A' ' 85' ' ' SER . 0.0 OUTLIER -101.43 -178.25 3.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.679 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.521 ' HG ' HD23 ' A' ' 83' ' ' LEU . 6.8 tt -167.92 103.55 0.48 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.071 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.437 HG22 ' HG3' ' A' ' 58' ' ' GLU . 24.8 t -94.88 138.98 19.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.543 179.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.754 ' HA ' HG23 ' A' ' 81' ' ' VAL . 6.1 p90 -147.85 161.95 40.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 0.0 111.31 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -128.52 120.24 26.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.438 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.518 ' N ' HD13 ' A' ' 71' ' ' ILE . 3.0 mm -84.71 141.51 14.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.38 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.427 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -127.45 87.5 2.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.695 179.806 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -56.39 -22.53 32.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.248 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -50.11 -32.82 16.83 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.891 0.377 . . . . 0.0 111.118 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -142.9 16.6 1.95 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.179 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 47.43 68.3 0.67 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.843 0.354 . . . . 0.0 111.22 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.665 HG23 ' HB ' ' A' ' 3' ' ' THR . 88.7 m -133.41 136.29 45.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.911 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.572 ' HB2' HD12 ' A' ' 2' ' ' LEU . 34.3 tp -95.06 92.37 6.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.727 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -90.08 115.74 27.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.966 -179.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.622 HD12 HG22 ' A' ' 6' ' ' THR . 30.6 mt -73.27 171.52 12.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.742 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.754 HG23 ' HA ' ' A' ' 69' ' ' TYR . 57.9 t -133.51 -70.22 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.291 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -118.45 175.78 5.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.117 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.521 HD23 ' HG ' ' A' ' 67' ' ' LEU . 0.4 OUTLIER -173.47 90.96 0.08 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.849 -179.983 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.62 127.92 1.49 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.749 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.478 ' HA ' HD11 ' A' ' 66' ' ' LEU . 0.6 OUTLIER -54.33 154.91 4.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.829 0.347 . . . . 0.0 111.127 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.84 -33.59 75.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.897 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.36 -32.35 60.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.875 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -67.18 -48.06 69.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.912 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.91 -39.23 93.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.823 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.288 -0.863 . . . . 0.0 110.868 -179.999 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.5 ttt . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.88 0.371 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.823 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -103.86 136.63 43.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.808 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.467 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -57.96 -176.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.015 -179.806 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.51 HG12 HG21 ' A' ' 31' ' ' VAL . 4.3 mp -136.36 115.26 15.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.994 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -108.64 159.68 16.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.813 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 39.9 p -139.19 150.05 45.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.926 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.4 ' HB2' ' CZ ' ' A' ' 79' ' ' PHE . 0.1 OUTLIER -118.19 -168.83 1.59 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.944 179.975 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -78.07 -46.08 21.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.898 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -61.47 -33.79 74.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.771 ' CZ ' HD11 ' A' ' 14' ' ' LEU . 13.2 t80 -69.88 -37.68 76.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -72.94 -29.52 63.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.978 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -76.22 -23.19 54.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.153 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.456 ' OD1' HD11 ' A' ' 89' ' ' LEU . 0.4 OUTLIER -84.37 -46.79 11.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.069 -179.817 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.771 HD11 ' CZ ' ' A' ' 10' ' ' PHE . 81.0 mt -59.79 -37.46 79.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.096 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt -56.95 -26.83 60.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.141 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.9 mm -82.45 -33.65 11.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.172 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.3 mt -79.99 -41.3 26.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.033 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.6 p -57.84 -29.55 35.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.157 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.2 tttt -81.21 -31.22 34.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.93 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -100.43 30.39 3.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.971 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.11 95.3 0.81 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.592 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.686 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 11.4 t80 -176.6 113.39 0.1 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.814 0.34 . . . . 0.0 110.831 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.499 ' HB2' HD23 ' A' ' 26' ' ' LEU . 5.0 m-20 -74.85 160.39 30.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.956 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.82 -28.2 14.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.993 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.9 mtmm -69.23 -29.6 67.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.957 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.686 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 4.4 pp -58.6 -30.97 67.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.953 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.64 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -75.99 -23.91 55.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.159 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -82.44 -30.55 29.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.785 0.326 . . . . 0.0 111.003 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -88.31 -33.46 18.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.031 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.546 HG22 ' HG ' ' A' ' 34' ' ' LEU . 10.8 p -62.74 -21.52 27.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.321 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.51 HG21 HG12 ' A' ' 4' ' ' ILE . 36.1 t -47.5 -38.33 5.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.293 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.422 ' O ' HG23 ' A' ' 36' ' ' THR . . . -64.27 -32.57 84.64 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.387 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -89.99 -23.19 21.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.748 0.309 . . . . 0.0 111.173 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.546 ' HG ' HG22 ' A' ' 30' ' ' VAL . 52.3 mt -69.77 -40.44 76.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.054 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.414 ' HB2' HD11 ' A' ' 2' ' ' LEU . . . -72.8 -36.6 67.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.276 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.422 HG23 ' O ' ' A' ' 32' ' ' GLY . 25.7 p -83.32 -42.5 17.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.93 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.448 ' HA ' HD11 ' A' ' 40' ' ' LEU . 13.3 mt-10 61.04 58.67 2.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.857 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.406 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 0.5 OUTLIER -88.71 -51.74 0.38 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.517 -179.65 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.406 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 63.1 Cg_endo -77.82 -91.29 0.0 OUTLIER 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 122.174 1.916 . . . . 0.0 112.696 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.57 HD21 ' HB2' ' A' ' 59' ' ' CYS . 3.1 mp 56.51 -178.85 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.801 0.334 . . . . 0.0 111.038 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -94.78 142.15 24.3 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.0 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -74.73 -24.47 13.39 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.553 2.169 . . . . 0.0 112.47 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.54 -29.23 26.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.093 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -95.36 -62.11 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.109 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 mmtt 62.33 149.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.847 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.422 ' HB2' ' CD2' ' A' ' 40' ' ' LEU . 40.8 t0 -93.72 142.5 27.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.997 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.5 p-80 -154.85 142.29 13.85 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.76 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -73.57 -168.2 0.43 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.482 2.121 . . . . 0.0 112.405 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mt -132.79 -174.95 3.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.751 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -158.12 172.37 18.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.937 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 75.01 50.13 8.94 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.369 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 106.36 -22.0 31.8 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.486 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.1 mt -122.46 93.98 4.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.689 0.28 . . . . 0.0 110.856 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.5 mmtp -101.64 -41.99 6.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.953 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 -72.35 -30.15 64.46 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.947 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -62.3 139.49 58.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.857 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 56.1 mtm180 -154.65 135.45 13.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.847 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -110.39 119.18 38.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.849 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.57 ' HB2' HD21 ' A' ' 40' ' ' LEU . 24.7 p -127.0 144.61 50.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.781 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -108.06 83.17 1.75 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.028 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 pp -59.04 -32.41 69.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.671 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.651 ' HB2' HD12 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -113.62 170.06 5.77 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.679 179.815 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.425 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 55.1 Cg_endo -70.1 -8.38 23.47 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.384 2.056 . . . . 0.0 112.781 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -151.43 40.69 0.69 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.739 0.304 . . . . 0.0 111.137 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.651 HD12 ' HB2' ' A' ' 62' ' ' LYS . 27.4 mt -131.59 133.7 45.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.052 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.653 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -113.96 116.16 28.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.716 179.739 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.722 ' HG ' HD12 ' A' ' 83' ' ' LEU . 0.4 OUTLIER -113.97 94.62 4.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.998 0.428 . . . . 0.0 111.143 -179.832 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.541 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 26.2 t -96.84 69.87 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.841 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.618 ' HD2' HD22 ' A' ' 67' ' ' LEU . 3.1 p90 -89.51 177.14 6.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.098 0.475 . . . . 0.0 111.345 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -146.15 122.51 10.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.709 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.547 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -92.65 138.17 20.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.852 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.09 102.5 11.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.658 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.63 -20.5 56.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.263 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -52.88 -29.42 28.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.734 0.302 . . . . 0.0 111.081 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -149.23 19.13 0.96 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.277 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 34.8 m120 46.46 74.77 0.14 Allowed 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.731 0.3 . . . . 0.0 111.303 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.467 HG23 ' HB ' ' A' ' 3' ' ' THR . 53.9 m -133.81 147.45 51.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.165 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.823 ' HB2' HD12 ' A' ' 2' ' ' LEU . 0.9 OUTLIER -107.4 95.59 5.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.553 179.596 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CZ ' ' HB2' ' A' ' 7' ' ' SER . 5.4 t80 -89.9 111.65 22.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.866 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.516 HD12 HD21 ' A' ' 67' ' ' LEU . 3.1 mm? -68.23 168.96 11.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.607 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.541 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 98.3 t -152.02 -84.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.432 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 11.1 mtm-85 -96.23 160.44 14.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.865 0.364 . . . . 0.0 111.254 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.722 HD12 ' HG ' ' A' ' 67' ' ' LEU . 0.3 OUTLIER -179.64 114.22 0.05 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.612 179.816 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.653 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 145.55 -159.93 28.0 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.42 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.414 ' O ' HD12 ' A' ' 89' ' ' LEU . 0.3 OUTLIER -121.22 141.05 51.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.809 0.338 . . . . 0.0 110.828 179.854 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -58.95 -30.35 67.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.914 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.1 m -78.23 -32.68 49.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.922 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -70.0 -46.88 64.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.958 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.456 HD11 ' OD1' ' A' ' 13' ' ' ASP . 4.0 mp -60.09 -31.51 70.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.92 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.965 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 ptp . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.899 0.38 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.804 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -128.82 133.52 48.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.922 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.648 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -65.51 -175.57 0.27 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.841 -179.994 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.557 HG12 HG11 ' A' ' 31' ' ' VAL . 4.2 mp -133.37 116.19 24.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.108 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -110.19 168.18 9.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.81 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.431 HG22 ' CE2' ' A' ' 10' ' ' PHE . 77.6 p -138.41 147.93 43.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.894 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.404 ' HB2' ' CE1' ' A' ' 79' ' ' PHE . 2.6 t -105.71 -168.19 1.42 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.886 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -74.53 -58.18 3.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.966 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -58.88 -34.56 71.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.964 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.593 ' HZ ' HD21 ' A' ' 27' ' ' LEU . 10.7 t80 -60.29 -34.86 74.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.927 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.32 -35.02 63.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.862 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.7 mtpp -82.11 -20.96 37.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.087 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.566 ' CG ' HD21 ' A' ' 89' ' ' LEU . 2.0 m-20 -84.1 -28.44 27.52 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.139 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -83.8 -36.49 23.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.161 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 12.6 pttp -58.6 -29.98 66.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.055 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.4 mm -83.62 -33.24 9.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.118 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.564 HD11 ' CA ' ' A' ' 84' ' ' GLY . 18.1 mt -73.68 -43.14 60.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.912 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.2 p -60.24 -30.93 47.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.11 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -72.92 -33.74 66.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.804 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -84.97 -48.74 8.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.927 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 163.3 76.95 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.501 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.867 ' CE1' HD11 ' A' ' 26' ' ' LEU . 56.4 t80 -153.07 116.8 4.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.858 0.361 . . . . 0.0 110.908 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.47 156.13 24.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.866 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.3 mp -91.36 -29.93 16.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.913 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -58.81 -36.87 75.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.97 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.867 HD11 ' CE1' ' A' ' 22' ' ' PHE . 3.9 pp -66.35 -30.67 71.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.885 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.593 HD21 ' HZ ' ' A' ' 10' ' ' PHE . 9.1 tp -71.71 -29.07 64.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.983 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.515 ' O ' HG22 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -83.21 -25.22 31.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.956 179.936 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 mttt -88.04 -34.45 17.99 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.075 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.4 p -60.28 -19.63 18.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.331 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.557 HG11 HG12 ' A' ' 4' ' ' ILE . 29.4 m -48.7 -41.06 12.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.827 0.346 . . . . 0.0 111.362 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.414 ' N ' HG23 ' A' ' 31' ' ' VAL . . . -60.66 -27.5 66.42 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.371 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -89.29 -30.01 18.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 0.0 110.871 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.3 mt -63.38 -38.07 89.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.873 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.93 -51.97 14.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.079 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.5 p -66.35 -44.54 82.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.917 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.749 ' HA ' HD11 ' A' ' 40' ' ' LEU . 33.6 mt-10 60.42 51.92 5.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.891 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.4 ' N ' ' CD ' ' A' ' 39' ' ' PRO . 0.5 OUTLIER -91.31 -52.12 0.3 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.233 -179.841 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.4 ' CD ' ' N ' ' A' ' 38' ' ' GLN . 74.3 Cg_endo -84.18 -92.13 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.406 2.071 . . . . 0.0 112.684 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.749 HD11 ' HA ' ' A' ' 37' ' ' GLU . 0.6 OUTLIER 54.55 36.78 26.63 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-O 120.849 0.357 . . . . 0.0 111.143 -179.967 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.54 127.95 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.08 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -77.27 -3.4 13.65 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.482 2.121 . . . . 0.0 112.832 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -102.63 -32.38 9.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 0.0 111.023 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -95.25 -52.68 4.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.904 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.2 mmtt 62.69 148.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.794 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.538 ' CB ' HD13 ' A' ' 40' ' ' LEU . 59.5 t0 -91.51 139.56 30.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.949 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 11.8 p-80 -158.42 146.42 13.78 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.79 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -73.18 -175.55 2.02 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.532 2.155 . . . . 0.0 112.337 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.511 HD12 ' HB2' ' A' ' 56' ' ' PHE . 35.7 mt -98.46 -69.75 0.75 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.883 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HB2' HD11 ' A' ' 53' ' ' LEU . 1.1 mttm -140.84 95.08 2.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.818 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -63.34 122.4 26.87 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.53 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 112.3 27.92 3.74 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.634 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.667 HD12 ' CG ' ' A' ' 54' ' ' LYS . 1.4 pp -179.04 -38.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.851 0.358 . . . . 0.0 111.014 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.667 ' CG ' HD12 ' A' ' 53' ' ' LEU . 11.4 mmtt -132.96 129.7 38.59 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.926 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -94.74 20.29 8.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.029 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.511 ' HB2' HD12 ' A' ' 49' ' ' LEU . 9.9 m-85 -78.02 143.98 37.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.832 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -156.4 142.8 18.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.595 -179.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.413 ' CG ' HG22 ' A' ' 68' ' ' VAL . 24.1 tt0 -128.5 148.89 50.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.124 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 32.1 p -137.15 -172.46 3.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.631 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 28.3 m-70 -143.73 85.84 1.85 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.981 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.701 ' CD2' HD12 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -61.01 -43.43 98.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.75 179.843 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.504 ' HD2' HD12 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -99.51 166.36 13.03 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.859 179.827 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.39 -3.53 14.02 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.749 2.299 . . . . 0.0 112.972 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -147.59 33.83 0.86 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.609 0.242 . . . . 0.0 111.08 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 mp -151.84 145.59 25.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.903 0.382 . . . . 0.0 111.098 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -110.53 -173.19 2.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.293 179.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.87 HD21 ' CD1' ' A' ' 80' ' ' LEU . 4.1 tt -169.99 103.58 0.31 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.876 0.37 . . . . 0.0 111.431 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.413 HG22 ' CG ' ' A' ' 58' ' ' GLU . 13.7 t -94.66 120.95 44.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.09 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.672 ' HD2' HD22 ' A' ' 67' ' ' LEU . 6.3 p90 -137.78 159.54 41.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.004 0.431 . . . . 0.0 111.433 -179.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -132.42 122.74 25.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.505 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.529 ' N ' HD13 ' A' ' 71' ' ' ILE . 3.0 mm -84.74 131.04 34.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.41 -179.568 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.431 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -111.82 85.02 2.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.665 179.757 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.0 mttt -56.19 -23.02 32.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.264 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -51.97 -30.38 24.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.845 0.355 . . . . 0.0 111.047 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -142.25 16.47 2.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.311 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 47.05 69.31 0.51 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.858 0.361 . . . . 0.0 111.311 179.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.648 HG23 ' HB ' ' A' ' 3' ' ' THR . 49.3 m -139.13 143.67 38.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.067 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.804 ' HB2' HD12 ' A' ' 2' ' ' LEU . 0.6 OUTLIER -97.29 96.45 8.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.668 179.722 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.408 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 3.7 t80 -94.39 114.19 26.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.945 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.87 ' CD1' HD21 ' A' ' 67' ' ' LEU . 3.0 mm? -69.62 169.86 11.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.797 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.574 HG23 ' HA ' ' A' ' 69' ' ' TYR . 35.1 t -136.41 -63.66 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.069 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.8 ttt85 -133.07 172.52 12.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.914 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.736 HD12 ' HG ' ' A' ' 67' ' ' LEU . 1.9 tt -176.84 146.53 0.55 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.949 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.564 ' CA ' HD11 ' A' ' 17' ' ' LEU . . . 99.94 129.52 6.64 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.488 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -52.68 138.93 27.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.84 0.352 . . . . 0.0 111.09 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -30.12 66.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.936 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.9 p -64.65 -32.96 74.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -73.73 -44.81 55.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.91 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.566 HD21 ' CG ' ' A' ' 13' ' ' ASP . 5.0 mp -64.58 -66.99 0.47 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.868 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.2 mtt . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.771 0.32 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.1 mt -102.77 151.66 22.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.898 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.691 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -69.39 -177.32 1.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.862 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.512 HG12 HG11 ' A' ' 31' ' ' VAL . 3.8 mp -133.8 116.91 24.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.196 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -110.49 159.81 17.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.712 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 34.2 p -130.93 149.85 52.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.115 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.9 t -106.13 -166.8 1.23 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.8 mtmm -82.85 -52.09 7.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.027 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.4 mmtp -70.24 -31.77 69.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.027 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.633 ' CE1' HD11 ' A' ' 14' ' ' LEU . 76.4 t80 -59.95 -53.66 55.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.884 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.29 -31.03 68.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.988 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -82.35 -20.03 38.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.179 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.515 ' O ' HD23 ' A' ' 17' ' ' LEU . 2.7 m-20 -85.37 -28.36 25.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.19 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.669 ' O ' HG23 ' A' ' 18' ' ' VAL . 3.9 mp -81.59 -37.65 27.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.162 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.1 ptpt -58.27 -29.77 66.07 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.089 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.1 mm -81.05 -43.81 20.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.069 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.574 ' CD1' HD21 ' A' ' 65' ' ' LEU . 2.1 mm? -56.62 -26.84 56.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.924 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.669 HG23 ' O ' ' A' ' 14' ' ' LEU . 20.6 t -57.41 -54.59 28.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.126 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.1 tptm -59.18 -28.67 66.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.08 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -97.84 33.57 2.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.973 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.79 88.35 0.38 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.486 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.456 ' CE1' HD11 ' A' ' 26' ' ' LEU . 7.4 t80 -176.56 166.84 2.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.74 0.305 . . . . 0.0 110.838 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -157.01 158.99 37.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.912 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -88.39 -29.68 20.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.003 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -63.58 -45.2 91.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.906 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.742 HD12 ' N ' ' A' ' 27' ' ' LEU . 4.3 pp -60.1 -31.63 70.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.921 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.742 ' N ' HD12 ' A' ' 26' ' ' LEU . 3.7 tt -76.26 -28.7 57.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.913 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.641 ' O ' HG22 ' A' ' 31' ' ' VAL . 0.2 OUTLIER -59.11 -29.49 67.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.907 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.61 -30.85 18.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.055 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.694 HG23 ' O ' ' A' ' 26' ' ' LEU . 34.6 t -64.38 -22.49 31.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.247 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 28' ' ' TYR . 29.1 m -50.35 -29.29 6.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.226 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -70.0 -33.74 70.24 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.397 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -86.32 -28.93 23.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.739 0.304 . . . . 0.0 110.881 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.547 ' HG ' HG12 ' A' ' 30' ' ' VAL . 90.0 mt -63.25 -38.31 90.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.831 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.24 -34.9 61.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.185 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 51.4 p -78.86 -41.35 30.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.837 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.409 ' HA ' HD21 ' A' ' 40' ' ' LEU . 26.8 mt-10 58.07 61.39 2.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.972 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.435 ' CB ' ' HD3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -102.48 -55.18 0.12 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.411 -179.79 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.435 ' HD3' ' CB ' ' A' ' 38' ' ' GLN . 41.7 Cg_endo -86.04 -76.36 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.379 2.053 . . . . 0.0 112.338 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.693 HD12 ' HB3' ' A' ' 59' ' ' CYS . 2.5 mm? 48.65 27.65 1.57 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.814 0.34 . . . . 0.0 111.433 179.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 62.11 121.01 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.116 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.95 -35.78 90.54 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.425 2.084 . . . . 0.0 112.388 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.73 -30.45 68.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.852 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -109.63 63.86 0.61 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.857 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.7 mttp -60.29 102.5 0.18 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.815 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -51.56 145.33 9.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.087 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -168.28 162.97 8.82 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.914 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.18 172.73 14.21 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.605 2.204 . . . . 0.0 112.353 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.91 -45.11 9.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.827 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt 68.69 151.74 0.09 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.952 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 111.35 -97.22 0.93 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.44 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -106.91 23.5 27.52 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.578 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.788 HD12 ' O ' ' A' ' 53' ' ' LEU . 1.0 OUTLIER 179.94 114.61 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.904 0.383 . . . . 0.0 110.8 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.4 -38.4 9.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.856 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.61 -18.23 61.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.182 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.501 ' HB2' HD13 ' A' ' 53' ' ' LEU . 4.3 m-85 -94.0 125.35 38.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.882 0.372 . . . . 0.0 110.908 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -145.07 155.26 43.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.783 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.41 ' HG3' HG22 ' A' ' 68' ' ' VAL . 29.7 tt0 -121.66 154.57 36.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.003 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.693 ' HB3' HD12 ' A' ' 40' ' ' LEU . 7.3 m -145.76 -169.99 3.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.895 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -139.03 110.8 7.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.898 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 1.056 HD23 HD12 ' A' ' 67' ' ' LEU . 3.7 pp -83.17 -38.26 22.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.85 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.42 ' CB ' ' HD2' ' A' ' 63' ' ' PRO . 2.7 mttm -108.13 169.36 6.69 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.788 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.42 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 47.5 Cg_endo -68.8 -9.39 26.1 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.466 2.11 . . . . 0.0 112.823 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -150.63 49.43 0.87 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.85 0.357 . . . . 0.0 110.941 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.574 HD21 ' CD1' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -159.31 140.66 12.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.113 180.0 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.62 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -101.53 -177.69 3.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.339 179.589 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 1.056 HD12 HD23 ' A' ' 61' ' ' LEU . 3.0 tt -170.02 102.64 0.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.821 0.343 . . . . 0.0 111.493 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.41 HG22 ' HG3' ' A' ' 58' ' ' GLU . 23.4 t -90.04 125.44 42.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.124 178.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.476 ' HD2' HD22 ' A' ' 67' ' ' LEU . 10.0 p90 -145.06 163.36 34.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.864 0.364 . . . . 0.0 111.422 -179.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.35 119.3 9.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.754 179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.564 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -85.07 146.32 6.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.9 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.52 103.7 10.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.88 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.3 mmtp -56.72 -21.93 31.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.212 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -47.44 -36.6 10.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.804 0.335 . . . . 0.0 111.312 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -148.36 20.99 1.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.194 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 48.96 73.59 0.22 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.853 0.359 . . . . 0.0 111.059 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.691 HG23 ' HB ' ' A' ' 3' ' ' THR . 99.8 m -132.45 147.4 52.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.915 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.01 91.81 3.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.732 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.42 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 4.3 t80 -89.94 121.11 31.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.833 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.994 HD12 HD21 ' A' ' 67' ' ' LEU . 3.0 mm? -76.76 176.08 8.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.74 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.439 HG23 ' HA ' ' A' ' 69' ' ' TYR . 60.5 t -145.35 -66.34 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.144 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 -123.39 169.07 11.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.962 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.4 HD13 HD11 ' A' ' 14' ' ' LEU . 8.7 tt -176.11 134.66 0.26 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.901 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.62 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 143.86 -141.43 10.28 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.591 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.3 m -134.61 175.62 9.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.907 0.385 . . . . 0.0 110.883 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -82.08 -32.58 30.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.4 m -78.65 -32.9 47.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.95 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.38 -58.77 3.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.905 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.27 -34.54 77.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.83 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.887 179.942 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.862 0.363 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.413 HD23 ' OD1' ' A' ' 76' ' ' ASN . 0.8 OUTLIER 63.32 139.01 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.912 179.951 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.643 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -68.36 -174.9 0.57 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.824 179.977 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -133.98 120.99 37.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.121 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -115.02 163.84 15.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.737 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.5 p -128.28 155.44 44.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.041 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 14.7 m -99.99 -178.37 3.83 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.984 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -74.16 -46.23 43.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.826 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -29.65 69.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.02 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.441 ' CE2' ' HB3' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -58.28 -38.98 78.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.997 179.975 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -61.86 -33.12 73.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.78 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -89.95 -21.63 22.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.139 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.443 ' OD1' HD21 ' A' ' 89' ' ' LEU . 86.7 m-20 -79.59 -25.94 41.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.155 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.1 mp -88.86 -38.44 14.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.26 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 48.6 pttt -57.86 -30.33 65.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.133 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.9 mm -85.19 -29.15 6.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.161 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.771 HD11 ' HA2' ' A' ' 84' ' ' GLY . 18.0 mt -81.22 -36.82 29.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.916 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.6 p -60.14 -26.21 35.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.111 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -90.09 -42.98 10.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.545 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.09 -30.88 69.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.534 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 147.87 80.35 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.41 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.937 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 8.9 t80 -157.57 171.88 19.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.941 0.401 . . . . 0.0 110.942 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -145.51 169.42 18.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.862 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.7 mp -97.67 -27.75 14.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.08 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -66.34 -34.18 77.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.952 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.937 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 3.9 pp -64.79 -34.34 78.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.892 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.568 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.6 OUTLIER -75.41 -41.25 56.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.883 179.965 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -72.42 -23.67 61.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.2 mmmt -90.04 -31.68 17.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.333 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.553 HG12 ' HA ' ' A' ' 27' ' ' LEU . 12.7 p -80.8 -7.4 10.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.865 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 27' ' ' LEU . 43.5 t -53.94 -42.02 51.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-O 120.778 0.323 . . . . 0.0 111.125 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.81 -27.0 72.33 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.379 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -87.2 -19.41 28.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.589 0.233 . . . . 0.0 111.159 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.5 mt -77.95 -38.29 45.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.918 0.389 . . . . 0.0 110.983 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.81 -33.03 73.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.244 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 71.2 p -97.87 -31.49 12.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 60.86 58.94 2.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.874 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.475 ' N ' ' HD2' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -75.35 -56.98 1.77 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.44 -179.876 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 38' ' ' GLN . 25.0 Cg_endo -62.23 -82.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.063 1.842 . . . . 0.0 112.468 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.418 HD22 ' N ' ' A' ' 40' ' ' LEU . 3.0 mm? 46.56 97.36 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.121 0 CA-C-O 120.873 0.368 . . . . 0.0 111.549 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.37 146.86 4.38 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.371 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.16 -25.35 19.14 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.564 2.176 . . . . 0.0 112.461 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.3 -28.12 61.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.166 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.412 ' HB3' ' CD2' ' A' ' 60' ' ' HIS . 58.9 m-85 -112.46 -66.79 1.05 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.156 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.3 tttt 63.06 149.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.867 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -76.33 121.46 23.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.841 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -149.22 163.97 23.03 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.899 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -68.35 161.92 42.72 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.532 2.154 . . . . 0.0 112.208 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.548 HD12 ' N ' ' A' ' 49' ' ' LEU . 5.3 mp -95.86 -70.93 0.69 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.03 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.577 ' CB ' HD21 ' A' ' 53' ' ' LEU . 6.1 mmtt -92.45 171.77 8.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.102 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -102.41 116.05 5.39 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.437 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 109.12 26.87 5.04 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.469 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.577 HD21 ' CB ' ' A' ' 50' ' ' LYS . 0.9 OUTLIER -163.95 108.03 0.99 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.745 0.307 . . . . 0.0 110.819 -179.966 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.45 32.29 2.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.968 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -94.72 -32.01 13.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.847 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -108.4 145.3 34.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.884 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -159.02 128.4 5.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.747 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.638 ' HB2' HG22 ' A' ' 68' ' ' VAL . 0.8 OUTLIER -105.88 136.28 45.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.0 -179.8 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 32.0 p -129.2 149.61 50.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.682 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.412 ' CD2' ' HB3' ' A' ' 44' ' ' TYR . 34.3 m-70 -107.12 86.05 2.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.142 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.509 HD12 ' N ' ' A' ' 62' ' ' LYS . 3.7 pp -59.22 -41.1 87.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.692 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.509 ' N ' HD12 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -111.98 167.67 8.79 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.748 179.738 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.8 -7.59 21.7 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.464 2.109 . . . . 0.0 112.943 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -148.32 42.37 1.0 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.762 0.315 . . . . 0.0 111.161 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 89.7 mt -154.33 135.63 14.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.906 0.384 . . . . 0.0 111.059 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.665 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -102.46 171.71 7.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.448 179.7 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.488 HD23 ' C ' ' A' ' 67' ' ' LEU . 5.6 tt -165.46 100.3 0.71 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.945 0.402 . . . . 0.0 111.356 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.638 HG22 ' HB2' ' A' ' 58' ' ' GLU . 33.6 t -96.18 135.44 30.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.034 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.689 ' HA ' HG23 ' A' ' 81' ' ' VAL . 5.8 p90 -146.0 161.98 38.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.995 0.426 . . . . 0.0 111.35 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -131.47 124.95 31.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.516 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.528 ' N ' HD13 ' A' ' 71' ' ' ILE . 2.9 mm -84.6 143.85 10.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.344 -179.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.415 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -127.85 87.72 2.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.714 179.848 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.7 pttt -57.69 -22.21 44.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.217 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -51.7 -32.21 29.12 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.847 0.356 . . . . 0.0 110.987 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -141.27 15.22 2.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.219 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.413 ' OD1' HD23 ' A' ' 2' ' ' LEU . 2.0 t30 47.54 69.91 0.47 Allowed 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 120.84 0.352 . . . . 0.0 111.156 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.643 HG23 ' HB ' ' A' ' 3' ' ' THR . 76.3 m -137.44 146.12 43.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.986 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 34.1 tp -101.0 92.33 4.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.776 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -90.77 114.02 26.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.86 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.441 ' HB3' ' CE2' ' A' ' 10' ' ' PHE . 2.6 mt -71.48 178.96 3.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.928 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.689 HG23 ' HA ' ' A' ' 69' ' ' TYR . 58.7 t -139.13 -70.85 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.105 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -129.99 171.49 12.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.975 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.7 tt -174.9 152.66 1.56 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.872 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.771 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 125.6 -156.99 19.56 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.467 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.3 t -119.99 133.93 55.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.933 0.397 . . . . 0.0 110.885 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -59.76 -47.73 84.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.972 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 25.1 p -64.56 -31.11 72.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.997 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -73.89 -56.51 4.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.443 HD21 ' OD1' ' A' ' 13' ' ' ASP . 3.3 mp -58.06 -30.78 66.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.981 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.944 179.997 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 tpt . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.91 0.386 . . . . 0.0 111.263 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.468 ' H ' HD12 ' A' ' 2' ' ' LEU . 0.7 OUTLIER -98.56 146.92 25.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.85 179.906 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.42 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.2 OUTLIER -60.66 -177.4 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.908 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -128.7 106.28 14.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.12 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -103.07 160.97 14.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.803 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.7 p -139.18 151.47 46.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.026 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 16.7 p -109.3 -168.57 1.35 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.821 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.0 -60.01 2.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.924 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.3 mttt -59.91 -33.36 71.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.906 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.442 ' CE1' ' HB3' ' A' ' 80' ' ' LEU . 75.1 t80 -59.46 -53.5 57.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.935 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.34 -29.96 69.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.028 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -83.47 -6.92 59.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.456 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.557 ' OD1' HD21 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -89.99 -29.76 18.23 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.689 0.281 . . . . 0.0 111.061 -179.816 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 pp -84.46 -38.39 20.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.071 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -59.19 -22.15 60.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.228 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.0 mm -88.98 -29.29 5.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.309 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.833 HD11 ' HA2' ' A' ' 84' ' ' GLY . 11.9 mt -79.79 -32.71 40.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.119 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.5 p -61.97 -30.83 49.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.141 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.65 -37.44 35.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.939 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -77.85 -31.33 51.44 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.869 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 145.58 80.17 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.526 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -153.48 161.16 42.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.831 0.348 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -107.96 172.58 6.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.905 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.582 ' N ' HD12 ' A' ' 24' ' ' LEU . 5.5 mp -99.47 -57.85 2.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.975 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -60.82 -21.5 63.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.053 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.904 ' O ' HG23 ' A' ' 30' ' ' VAL . 1.9 tm? -52.73 -54.07 38.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.881 0.372 . . . . 0.0 111.044 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 tt -61.02 -46.32 91.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.827 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.681 ' O ' HG22 ' A' ' 31' ' ' VAL . 4.8 m-85 -60.65 -25.09 66.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.998 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.68 -29.43 22.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.001 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 26' ' ' LEU . 25.6 t -67.76 -24.55 30.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.309 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.681 HG22 ' O ' ' A' ' 28' ' ' TYR . 32.1 m -48.02 -38.95 8.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.852 0.358 . . . . 0.0 111.38 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.23 -27.9 65.98 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.456 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -90.12 -22.45 21.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.662 0.268 . . . . 0.0 111.15 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.3 mt -69.33 -33.08 72.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.833 0.349 . . . . 0.0 110.93 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.75 -32.96 60.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.136 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.0 p -88.67 -46.24 9.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.667 ' C ' HD11 ' A' ' 40' ' ' LEU . 56.5 mt-10 62.03 55.61 2.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.861 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -93.86 -53.19 0.25 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.225 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -84.63 -88.89 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.49 2.126 . . . . 0.0 112.588 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.667 HD11 ' C ' ' A' ' 37' ' ' GLU . 0.4 OUTLIER 55.57 35.88 26.06 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.889 0.376 . . . . 0.0 111.134 179.934 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.585 ' HB1' ' HE2' ' A' ' 43' ' ' LYS . . . 60.14 109.4 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.069 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.82 -25.98 38.85 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.365 2.044 . . . . 0.0 112.414 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.585 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 3.3 pttt -66.78 -31.12 71.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.006 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -103.74 -39.3 6.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.933 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.5 mttm 63.61 127.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.879 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -61.39 146.57 47.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.017 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -160.13 150.7 15.38 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.826 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.41 ' HA ' ' HA ' ' A' ' 57' ' ' ARG . 17.9 Cg_endo -60.04 -78.71 0.01 OUTLIER 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.5 2.133 . . . . 0.0 112.36 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.538 HD12 ' O ' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -167.87 -73.96 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.89 0.376 . . . . 0.0 110.914 -179.949 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.2 mttm -157.42 114.42 3.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.879 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 64.73 -117.26 10.16 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.523 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.15 -140.46 0.16 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.484 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 13.1 mt 60.7 101.65 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.853 0.358 . . . . 0.0 110.827 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.0 mttp -109.16 -22.61 12.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.172 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.3 -32.93 67.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.949 0.404 . . . . 0.0 110.759 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.538 ' O ' HD12 ' A' ' 49' ' ' LEU . 20.9 m-85 -105.31 118.2 35.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.758 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.41 ' HA ' ' HA ' ' A' ' 48' ' ' PRO . 23.4 mtp180 -142.63 155.07 44.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.018 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.542 ' HB2' HG22 ' A' ' 68' ' ' VAL . 0.4 OUTLIER -129.79 143.14 50.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.839 179.972 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 21.1 m -134.94 177.43 7.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.837 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -130.18 83.4 2.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.958 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.738 HD22 HD12 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -55.92 -34.75 65.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.916 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 65' ' ' LEU . 12.8 mmtt -117.92 163.72 23.2 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.681 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.8 -19.29 30.6 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.654 2.236 . . . . 0.0 112.467 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -148.66 76.38 1.35 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.711 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 62' ' ' LYS . 0.2 OUTLIER -175.57 122.13 0.2 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.139 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.407 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -89.95 157.03 18.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.2 179.464 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.96 HD21 HD12 ' A' ' 80' ' ' LEU . 5.6 tt -153.16 98.35 2.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.902 0.382 . . . . 0.0 111.391 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.542 HG22 ' HB2' ' A' ' 58' ' ' GLU . 34.8 t -94.09 134.1 32.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.284 179.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.465 ' HB3' HD13 ' A' ' 80' ' ' LEU . 5.1 p90 -146.26 158.28 43.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.996 0.427 . . . . 0.0 111.312 -179.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -135.24 109.35 8.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.637 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.568 ' N ' HD12 ' A' ' 71' ' ' ILE . 1.5 mp -84.97 141.22 14.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.837 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.69 103.54 10.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.72 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm -59.98 -19.71 53.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.417 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -30.34 36.4 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.747 0.308 . . . . 0.0 111.142 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -148.57 19.71 1.04 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.339 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 46.98 75.3 0.13 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.751 0.31 . . . . 0.0 111.283 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.42 HG23 ' HB ' ' A' ' 3' ' ' THR . 96.6 m -133.99 148.48 51.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.942 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.56 91.46 3.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.66 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.441 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 6.1 t80 -89.93 110.96 21.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.92 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.96 HD12 HD21 ' A' ' 67' ' ' LEU . 3.4 mm? -70.41 -178.01 1.62 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.603 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 82.5 t -152.47 -72.42 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.304 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.08 163.85 11.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.914 0.387 . . . . 0.0 111.096 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.464 HD13 ' C ' ' A' ' 83' ' ' LEU . 1.7 tm? -177.09 87.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.926 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.833 ' HA2' HD11 ' A' ' 17' ' ' LEU . . . 177.7 -136.61 3.1 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.512 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -140.32 147.86 40.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.744 0.307 . . . . 0.0 110.895 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -59.2 -39.8 83.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.062 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.1 t -75.42 -37.49 60.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.976 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.1 -57.82 5.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.922 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.557 HD21 ' OD1' ' A' ' 13' ' ' ASP . 2.2 mm? -64.78 -62.28 1.66 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.856 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.958 179.949 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.469 ' C ' HD23 ' A' ' 2' ' ' LEU . 2.9 ptp . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 120.863 0.363 . . . . 0.0 111.215 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.833 HD12 ' HB2' ' A' ' 78' ' ' LEU . 0.1 OUTLIER -156.76 140.16 15.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.869 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.448 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -73.32 -175.72 2.0 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.793 179.937 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.777 HG12 HG11 ' A' ' 31' ' ' VAL . 4.1 mp -130.31 124.18 57.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.003 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -117.2 162.84 17.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.801 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 44.1 p -126.12 153.67 44.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.951 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.7 t -102.87 177.12 4.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.021 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.7 mtmm -74.02 -43.89 56.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.861 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.7 mmtm -79.07 -28.21 43.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.934 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.581 ' CE2' HD11 ' A' ' 14' ' ' LEU . 31.7 t80 -55.83 -34.33 65.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.978 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.474 ' HA ' HD12 ' A' ' 14' ' ' LEU . 73.6 m-20 -68.12 -31.69 71.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.867 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -78.63 -22.02 47.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.166 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.04 -27.34 33.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.107 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.581 HD11 ' CE2' ' A' ' 10' ' ' PHE . 4.8 mt -81.11 -37.77 28.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.106 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.458 ' HA ' HG12 ' A' ' 18' ' ' VAL . 15.7 ptmt -57.47 -28.85 63.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.129 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.9 mm -78.74 -28.72 14.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.328 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.623 ' CD1' HD21 ' A' ' 65' ' ' LEU . 26.5 mt -87.48 -40.68 14.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.115 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.458 HG12 ' HA ' ' A' ' 15' ' ' LYS . 12.5 p -57.62 -32.17 41.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.2 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt -77.54 -31.17 53.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.935 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -100.37 29.89 4.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.917 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.16 98.44 0.54 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.539 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.521 ' CE1' HD11 ' A' ' 26' ' ' LEU . 55.4 t80 -176.88 97.86 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.82 0.343 . . . . 0.0 110.932 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.406 ' HB3' HD23 ' A' ' 26' ' ' LEU . 4.7 t0 -68.83 160.87 29.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.889 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -94.21 -31.0 14.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.894 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.73 -34.86 73.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.977 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.521 HD11 ' CE1' ' A' ' 22' ' ' PHE . 4.2 pp -61.15 -35.68 77.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.869 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.501 ' HA ' HG12 ' A' ' 30' ' ' VAL . 4.5 tp -77.07 -29.48 55.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.972 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.627 ' O ' HG22 ' A' ' 31' ' ' VAL . 2.5 m-85 -79.49 -25.54 41.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.069 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.34 -32.06 17.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.088 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.501 HG12 ' HA ' ' A' ' 27' ' ' LEU . 13.7 p -71.39 -14.32 17.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.582 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.777 HG11 HG12 ' A' ' 4' ' ' ILE . 18.3 m -51.73 -46.35 38.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.841 0.353 . . . . 0.0 111.365 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.472 ' N ' HG23 ' A' ' 31' ' ' VAL . . . -62.65 -26.39 68.41 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.413 179.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -88.71 -19.59 25.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.637 0.256 . . . . 0.0 111.162 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.863 HD21 ' HB3' ' A' ' 61' ' ' LEU . 70.7 mt -72.23 -45.93 58.2 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.842 0.353 . . . . 0.0 111.012 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.446 ' HB2' HD11 ' A' ' 2' ' ' LEU . . . -63.83 -30.59 71.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.23 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 73.5 p -92.38 -35.61 13.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.899 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 60.01 61.59 1.84 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.874 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.47 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 2.5 mt-30 -79.94 -56.67 0.73 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.564 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.47 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 36.5 Cg_endo -66.27 -86.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.029 1.819 . . . . 0.0 112.327 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.484 HD22 ' N ' ' A' ' 40' ' ' LEU . 3.6 mm? 44.63 92.64 0.01 OUTLIER 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.775 0.321 . . . . 0.0 111.625 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.708 ' HB1' ' HD2' ' A' ' 42' ' ' PRO . . . -59.33 165.63 3.69 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.708 ' HD2' ' HB1' ' A' ' 41' ' ' ALA . 11.2 Cg_endo -54.6 -68.95 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.522 2.148 . . . . 0.0 112.196 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.04 -30.65 71.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.753 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -108.56 55.08 0.64 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.693 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.96 -162.22 0.94 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.766 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -113.2 155.2 25.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.869 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 11.3 p-80 -165.6 145.42 5.5 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.825 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -73.03 159.51 47.69 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.597 2.198 . . . . 0.0 112.298 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.604 HD13 ' HB3' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -88.82 -44.97 10.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.893 179.924 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.2 mtmp? 62.86 142.67 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.866 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 110.98 35.78 1.94 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.4 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 101.76 -35.11 5.14 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.442 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -91.14 52.79 2.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.861 0.362 . . . . 0.0 110.832 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.0 mttm -60.07 -34.69 73.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.855 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -65.82 -40.05 91.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.865 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.604 ' HB3' HD13 ' A' ' 49' ' ' LEU . 10.1 m-85 -64.85 157.93 26.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.9 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.2 mtt85 -166.84 137.37 3.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.846 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.407 ' CG ' HG22 ' A' ' 68' ' ' VAL . 31.1 tt0 -109.68 130.66 55.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.904 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.2 p -144.64 175.35 10.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.839 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 55.9 m-70 -129.36 93.06 3.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.838 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.863 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -59.5 -34.56 72.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.906 179.925 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.404 ' HB2' ' HB2' ' A' ' 65' ' ' LEU . 0.1 OUTLIER -110.28 164.99 13.52 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.677 179.955 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.61 -12.69 34.86 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.508 2.139 . . . . 0.0 112.81 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.796 ' O ' HD12 ' A' ' 65' ' ' LEU . 3.1 t0 -149.91 65.38 0.98 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.953 0.406 . . . . 0.0 110.967 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.796 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.1 OUTLIER -163.88 159.29 20.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.853 179.91 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.688 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.3 OUTLIER -116.72 169.77 9.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.831 179.845 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.938 HD13 HD12 ' A' ' 83' ' ' LEU . 15.6 tp -170.01 94.91 0.26 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.031 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.543 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 39.2 t -99.49 69.65 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.897 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.581 ' CD1' HD21 ' A' ' 78' ' ' LEU . 9.2 p90 -89.52 172.89 8.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.057 0.456 . . . . 0.0 111.487 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HB2' ' CD1' ' A' ' 56' ' ' PHE . 22.0 tt0 -142.72 141.06 31.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.641 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.568 ' N ' HD13 ' A' ' 71' ' ' ILE . 2.8 mm -84.79 147.91 5.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.357 -179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.444 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -122.28 87.81 2.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.616 179.522 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.8 mmtt -53.01 -23.87 8.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.388 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -47.18 -33.12 4.95 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.194 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -149.07 20.45 0.98 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.193 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.8 m120 47.29 67.8 0.74 Allowed 'General case' 0 C--O 1.231 0.106 0 CA-C-O 120.848 0.356 . . . . 0.0 111.261 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.448 HG23 ' HB ' ' A' ' 3' ' ' THR . 16.0 m -133.96 150.82 51.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.05 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.833 ' HB2' HD12 ' A' ' 2' ' ' LEU . 1.1 tt -102.34 100.6 10.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.407 179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CE1' ' O ' ' A' ' 80' ' ' LEU . 2.6 t80 -93.77 112.7 24.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.017 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.576 HD12 ' CE2' ' A' ' 10' ' ' PHE . 23.1 mt -67.39 175.18 2.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.712 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.543 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 73.2 t -149.39 -85.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.414 -179.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.547 ' O ' HD12 ' A' ' 67' ' ' LEU . 2.7 mtt85 -99.0 162.51 13.03 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.917 0.389 . . . . 0.0 111.059 -179.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.938 HD12 HD13 ' A' ' 67' ' ' LEU . 1.3 tt -176.5 127.48 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.87 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.688 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 154.87 -166.5 32.46 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.437 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.8 m -118.3 145.56 44.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.854 0.359 . . . . 0.0 110.903 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 13.2 p80 -62.22 -34.54 76.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.9 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.88 -34.08 77.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.909 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -79.61 -63.98 1.29 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.942 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.5 mp -61.08 -74.75 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.829 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.931 -179.975 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.896 0.379 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.63 HD23 ' HA ' ' A' ' 76' ' ' ASN . 1.7 mp -145.36 154.73 42.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.825 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.96 -177.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.802 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.4 mp -132.14 107.36 12.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.167 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -105.28 167.63 9.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.654 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.8 p -135.87 157.65 46.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.172 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.44 ' HB3' ' CE1' ' A' ' 79' ' ' PHE . 59.8 p -113.86 -176.57 2.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.04 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.9 mmmt -71.16 -58.41 3.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.848 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 26.4 mttp -58.38 -30.36 66.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.876 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CZ ' HD13 ' A' ' 80' ' ' LEU . 93.3 t80 -58.66 -33.72 70.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -66.71 -43.19 84.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.954 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.1 mttt -74.36 -20.12 60.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.237 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.491 ' OD1' HD21 ' A' ' 89' ' ' LEU . 1.3 m-20 -86.47 -27.31 24.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.181 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.89 -36.74 19.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.117 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.483 ' HE3' HD11 ' A' ' 16' ' ' ILE . 1.5 pttt -58.51 -29.06 65.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.209 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.483 HD11 ' HE3' ' A' ' 15' ' ' LYS . 30.2 mm -81.46 -29.16 10.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.285 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.408 HD13 ' CD2' ' A' ' 83' ' ' LEU . 24.3 mt -82.11 -39.94 22.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.076 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.8 p -58.19 -30.44 39.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.163 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.86 -28.99 25.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.932 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -98.45 31.19 2.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.833 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.21 90.57 0.93 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.524 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.577 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 11.1 t80 -175.43 93.76 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.821 0.343 . . . . 0.0 110.863 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -69.81 167.12 17.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.849 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -92.1 -31.01 15.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.962 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.83 -34.61 73.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.577 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 3.9 pp -60.12 -35.51 75.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.938 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.473 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.2 OUTLIER -67.75 -29.71 68.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.897 179.997 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.634 ' O ' HG12 ' A' ' 31' ' ' VAL . 18.6 m-85 -82.27 -28.83 31.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.956 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.2 -32.83 19.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.037 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.464 HG12 ' HA ' ' A' ' 27' ' ' LEU . 14.7 p -68.25 -21.33 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.418 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.634 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.0 p -48.43 -29.29 2.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.437 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.02 -29.35 72.4 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.458 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -89.99 -26.74 20.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.687 0.279 . . . . 0.0 110.956 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.457 HD22 ' CD2' ' A' ' 67' ' ' LEU . 65.8 mt -63.92 -42.77 97.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.943 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.75 -35.98 70.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.067 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.0 p -76.67 -46.61 24.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.89 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.757 ' HA ' HD11 ' A' ' 40' ' ' LEU . 40.2 mt-10 59.34 48.84 9.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.919 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.407 ' HB2' ' HD3' ' A' ' 39' ' ' PRO . 2.1 mt-30 -90.27 -52.1 0.33 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.195 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.407 ' HD3' ' HB2' ' A' ' 38' ' ' GLN . 73.6 Cg_endo -83.36 -92.77 0.0 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.381 2.054 . . . . 0.0 112.823 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.757 HD11 ' HA ' ' A' ' 37' ' ' GLU . 0.5 OUTLIER 53.82 28.95 8.96 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-O 120.801 0.334 . . . . 0.0 111.025 -179.951 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.477 ' HB1' ' HE2' ' A' ' 43' ' ' LYS . . . 66.66 140.77 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.001 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.38 -40.65 2.93 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.511 2.141 . . . . 0.0 112.563 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.477 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -54.09 -42.06 68.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.114 -179.754 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.457 ' CE1' ' HG3' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -146.17 72.21 1.28 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.947 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.4 mttt -56.63 -79.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.984 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.1 t0 -178.4 140.28 0.2 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.752 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 16.9 p-80 -146.54 145.16 22.43 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -74.89 176.67 9.56 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.499 2.133 . . . . 0.0 112.365 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.1 mt -117.74 -175.62 2.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.82 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.81 167.17 30.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.941 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.64 -54.39 0.79 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.343 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.64 36.35 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.549 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.522 HD22 ' HD2' ' A' ' 56' ' ' PHE . 1.0 OUTLIER -137.89 -64.38 0.54 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.769 0.319 . . . . 0.0 110.876 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.6 mtmm 61.09 33.71 19.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.939 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -138.09 -45.7 0.52 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.878 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.522 ' HD2' HD22 ' A' ' 53' ' ' LEU . 24.0 m-85 -60.29 150.98 28.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.92 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 -161.91 142.91 10.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.742 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -125.82 140.31 52.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.145 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.716 ' HB2' HD22 ' A' ' 40' ' ' LEU . 31.6 p -144.31 160.29 41.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.804 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -108.31 82.19 1.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.985 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.482 HD23 ' HB2' ' A' ' 67' ' ' LEU . 3.9 pp -59.76 -33.24 71.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.823 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.573 ' HD2' HD13 ' A' ' 65' ' ' LEU . 1.0 OUTLIER -110.72 170.36 5.37 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.643 179.845 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.44 ' HD2' ' CB ' ' A' ' 62' ' ' LYS . 43.4 Cg_endo -68.43 -8.6 23.53 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.431 2.087 . . . . 0.0 112.893 -179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.816 ' O ' HD12 ' A' ' 65' ' ' LEU . 1.4 t0 -158.49 58.79 0.45 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.865 0.364 . . . . 0.0 111.038 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.816 HD12 ' O ' ' A' ' 64' ' ' ASP . 3.4 mp -151.9 150.84 30.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.054 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.692 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -119.22 106.78 12.68 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.501 179.796 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.55 HD11 HD22 ' A' ' 80' ' ' LEU . 40.0 tp -96.28 97.26 9.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.95 0.405 . . . . 0.0 111.479 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.501 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 27.6 t -94.85 123.73 47.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.062 178.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.477 ' CD1' ' CD1' ' A' ' 71' ' ' ILE . 2.4 p90 -140.8 177.71 7.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.915 0.388 . . . . 0.0 111.285 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.83 106.49 4.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.643 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.614 HG23 HD22 ' A' ' 2' ' ' LEU . 1.5 mp -84.96 137.85 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.896 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.401 ' CG ' ' HB ' ' A' ' 77' ' ' THR . 0.0 OUTLIER -118.01 101.72 8.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.568 179.739 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.6 ptpp? -60.19 -20.72 59.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.279 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.65 -32.01 49.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.838 0.352 . . . . 0.0 111.025 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -145.21 17.14 1.54 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.273 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.63 ' HA ' HD23 ' A' ' 2' ' ' LEU . 21.2 m120 46.92 74.46 0.15 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.789 0.328 . . . . 0.0 111.336 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.401 ' HB ' ' CG ' ' A' ' 72' ' ' LYS . 98.6 m -134.08 139.48 45.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.925 0.393 . . . . 0.0 110.955 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.06 94.36 5.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.639 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.44 ' CE1' ' HB3' ' A' ' 7' ' ' SER . 3.4 t80 -92.2 112.88 24.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.986 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.55 HD22 HD11 ' A' ' 67' ' ' LEU . 16.1 mt -71.66 171.07 12.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.707 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.501 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 92.7 t -147.65 -65.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.084 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -115.73 166.03 12.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.06 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.549 HD23 HD23 ' A' ' 65' ' ' LEU . 0.9 OUTLIER -178.92 119.73 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.885 179.899 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.692 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 143.63 -168.53 26.3 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.449 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.497 ' O ' HD23 ' A' ' 89' ' ' LEU . 8.1 t -100.32 172.59 7.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.852 0.358 . . . . 0.0 110.972 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -79.04 -40.46 31.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.857 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.7 m -74.26 -31.35 62.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.871 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.15 -31.86 70.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.85 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.497 HD23 ' O ' ' A' ' 85' ' ' SER . 3.1 mm? -76.19 -75.33 0.19 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.785 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.922 -179.977 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 mtm . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.84 0.353 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 mt -132.42 132.88 43.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.551 ' HB ' HG23 ' A' ' 77' ' ' THR . 0.3 OUTLIER -60.19 -175.47 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.763 -179.971 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.3 mp -132.04 118.13 35.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.073 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -111.79 168.65 9.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.896 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.6 p -143.45 148.41 36.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.999 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 79' ' ' PHE . 6.9 p -109.81 -171.1 1.77 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.903 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm -79.78 -33.92 40.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.668 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.407 ' HA ' ' CD ' ' A' ' 12' ' ' LYS . 4.5 mttp -80.5 -26.45 38.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.934 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.596 ' HZ ' HD11 ' A' ' 27' ' ' LEU . 35.9 t80 -72.01 -30.63 65.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.934 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.12 -39.38 49.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.128 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.407 ' CD ' ' HA ' ' A' ' 9' ' ' LYS . 2.2 ptmm? -75.74 -13.14 60.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.421 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -90.11 -32.33 16.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.686 0.279 . . . . 0.0 111.056 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.405 HD12 HD12 ' A' ' 83' ' ' LEU . 1.3 tp -79.48 -40.17 30.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.165 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -57.4 -23.28 48.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.234 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.9 mm -86.05 -29.86 6.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.172 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.445 HD11 ' CA ' ' A' ' 84' ' ' GLY . 4.3 mt -85.96 -34.02 20.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.934 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.3 p -60.42 -34.91 59.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.1 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.03 -46.09 58.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.844 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -73.15 -30.9 63.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.928 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 146.91 84.91 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.41 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.577 ' CZ ' HD11 ' A' ' 26' ' ' LEU . 8.3 t80 -164.66 99.11 0.79 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.712 0.291 . . . . 0.0 110.882 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.73 166.22 11.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.843 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.3 mp -98.04 -29.99 12.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.859 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.7 -32.64 74.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.957 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.577 HD11 ' CZ ' ' A' ' 22' ' ' PHE . 4.0 pp -59.6 -31.69 69.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.855 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.596 HD11 ' HZ ' ' A' ' 10' ' ' PHE . 0.9 OUTLIER -67.97 -26.66 66.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.066 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.679 ' O ' HG12 ' A' ' 31' ' ' VAL . 32.3 m-85 -79.76 -26.83 40.57 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.058 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.72 -29.64 19.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.16 -179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.535 HG12 ' HA ' ' A' ' 27' ' ' LEU . 14.8 p -74.25 -25.56 19.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.213 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.679 HG12 ' O ' ' A' ' 28' ' ' TYR . 12.6 p -49.03 -29.36 2.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.333 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -67.57 -29.11 73.68 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.342 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -89.99 -32.77 16.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.911 0.386 . . . . 0.0 110.958 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 40.6 mt -68.08 -41.64 81.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.833 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.07 -40.02 94.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.118 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 68.3 p -75.67 -36.68 60.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.876 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.943 ' HA ' HD21 ' A' ' 40' ' ' LEU . 27.5 mt-10 59.8 52.54 5.36 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.863 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -96.42 -52.82 0.22 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.595 -179.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -81.78 -82.57 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.383 2.055 . . . . 0.0 113.238 -179.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.943 HD21 ' HA ' ' A' ' 37' ' ' GLU . 0.6 OUTLIER 48.69 40.72 16.43 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.895 0.378 . . . . 0.0 111.136 -179.506 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 63.69 132.66 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.085 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.407 ' HA ' ' HD2' ' A' ' 45' ' ' LYS . 70.1 Cg_endo -74.24 -25.26 13.72 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.497 2.131 . . . . 0.0 112.451 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.31 -28.34 38.23 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.071 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.42 ' HB3' ' CD2' ' A' ' 60' ' ' HIS . 14.6 m-85 -103.19 -61.5 1.4 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.026 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.407 ' HD2' ' HA ' ' A' ' 42' ' ' PRO . 0.0 OUTLIER 63.9 140.38 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.839 -179.958 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.577 ' OD1' HD23 ' A' ' 40' ' ' LEU . 4.2 p-10 -59.7 151.17 25.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.909 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -162.76 146.65 8.97 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.9 157.16 51.89 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.462 2.108 . . . . 0.0 112.366 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.23 -46.44 11.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.839 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 60.81 30.5 19.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.904 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -82.75 -52.46 3.88 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.539 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.73 -40.04 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.504 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.706 HD13 ' CE1' ' A' ' 56' ' ' PHE . 1.3 mt -75.77 -32.97 60.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.799 0.333 . . . . 0.0 110.864 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 43.4 mttp 58.54 22.54 9.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.142 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -119.03 -34.96 3.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.973 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.706 ' CE1' HD13 ' A' ' 53' ' ' LEU . 10.9 m-85 -66.0 176.01 1.83 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.009 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -177.41 130.57 0.16 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.65 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.464 ' HG3' HG22 ' A' ' 68' ' ' VAL . 24.2 tt0 -103.23 137.98 40.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.985 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 15.1 m -141.97 -176.29 4.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.83 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.42 ' CD2' ' HB3' ' A' ' 44' ' ' TYR . 23.4 m-70 -143.26 93.76 2.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.914 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.999 HD22 HD12 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -70.66 -29.55 65.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.902 179.858 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.501 ' HB2' HD13 ' A' ' 65' ' ' LEU . 1.2 mttp -121.69 162.77 34.83 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.809 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.69 -12.76 32.94 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.602 2.202 . . . . 0.0 112.772 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.589 ' O ' HD12 ' A' ' 65' ' ' LEU . 20.6 t70 -148.75 65.7 1.05 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.83 0.348 . . . . 0.0 111.254 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.589 HD12 ' O ' ' A' ' 64' ' ' ASP . 0.8 OUTLIER -163.25 149.61 12.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.025 179.886 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.71 HD12 ' O ' ' A' ' 84' ' ' GLY . 0.3 OUTLIER -115.86 149.01 39.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.633 179.817 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.999 HD12 HD22 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -149.66 93.32 2.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.131 -179.834 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.508 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 38.7 t -95.37 69.4 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.968 0.413 . . . . 0.0 110.794 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.689 ' HD2' HD22 ' A' ' 67' ' ' LEU . 9.9 p90 -89.64 168.64 11.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.457 -179.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.591 ' C ' HD12 ' A' ' 71' ' ' ILE . 5.7 pt20 -137.64 141.13 41.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.692 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.591 HD12 ' C ' ' A' ' 70' ' ' GLN . 1.4 mp -108.79 119.67 58.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.792 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.408 ' HB2' ' HG2' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -93.23 99.21 11.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.655 179.831 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.3 mttp -60.73 -28.1 68.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.359 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.408 ' HG2' ' HB2' ' A' ' 72' ' ' LYS . 4.8 pt20 -52.87 -28.36 22.7 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.836 0.351 . . . . 0.0 111.149 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -139.7 10.94 2.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.558 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 46.82 76.14 0.11 Allowed 'General case' 0 N--CA 1.461 0.1 0 CA-C-O 120.838 0.351 . . . . 0.0 111.335 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.551 HG23 ' HB ' ' A' ' 3' ' ' THR . 54.8 m -139.85 150.21 44.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.933 0.397 . . . . 0.0 111.036 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.627 HD23 HG23 ' A' ' 31' ' ' VAL . 23.0 tp -107.14 93.84 4.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.434 179.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 7' ' ' SER . 4.3 t80 -89.87 107.33 19.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.841 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.557 HD13 ' CZ ' ' A' ' 10' ' ' PHE . 1.9 mt -71.36 173.93 7.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.96 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.508 ' HB ' ' O ' ' A' ' 68' ' ' VAL . 90.5 t -151.92 -84.55 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.203 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.492 ' CZ ' HD13 ' A' ' 66' ' ' LEU . 34.8 ttt180 -83.42 163.28 20.65 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.949 0.404 . . . . 0.0 110.771 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.458 HD13 HD23 ' A' ' 65' ' ' LEU . 1.3 tm? -175.49 95.12 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.889 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.71 ' O ' HD12 ' A' ' 66' ' ' LEU . . . 144.25 -168.67 26.56 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.622 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.9 t -112.96 159.41 19.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.756 0.312 . . . . 0.0 110.97 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -62.43 -39.34 93.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.909 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 23.6 m -71.4 -33.22 69.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.921 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.33 -48.12 65.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.884 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.7 mp -59.3 -29.3 67.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.023 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.248 0.984 0 CA-C-O 118.171 -0.919 . . . . 0.0 110.956 179.941 . . . . . . . . 1 1 . 1 stop_ save_