data_2llo_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 2llo _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 . . . . . 0 N--CA 1.452 -0.359 0 N-CA-C 111.551 0.204 . . . . 1.18 111.551 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -74.49 -40.93 61.53 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.08 -0.711 . . . . 1.8 109.08 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -68.43 -22.36 64.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.455 -0.793 . . . . 1.39 110.331 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.414 ' CG ' ' HE3' ' B' ' 299' ' ' LYS . 5.1 tp10 -69.62 -27.12 64.81 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.653 -0.703 . . . . 1.29 110.478 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.32 -47.6 85.19 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.673 -0.491 . . . . 0.85 109.673 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -73.89 3.46 6.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.069 0.462 . . . . 1.25 111.61 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.4 m -112.76 -35.0 5.62 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.258 -0.428 . . . . 0.94 111.886 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.4 mt -105.13 -26.44 12.09 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.144 0.424 . . . . 0.89 112.144 -178.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -83.0 -49.06 9.97 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 121.043 -0.263 . . . . 1.03 111.318 -178.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -92.24 140.02 30.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.955 0.407 . . . . 0.59 111.166 -179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -125.43 3.44 7.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.0 -0.545 . . . . 2.09 110.5 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -90.17 -28.6 18.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.161 0.505 . . . . 0.82 109.976 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.89 27.7 9.34 Favored Glycine 0 N--CA 1.444 -0.784 0 N-CA-C 111.118 -0.793 . . . . 0.87 111.118 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -100.48 -31.54 11.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.305 -0.448 . . . . 0.74 111.126 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 69.45 36.99 78.58 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.867 -0.683 . . . . 1.3 112.085 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.3 p -139.4 152.96 47.52 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.823 -0.436 . . . . 1.11 109.823 179.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.613 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 74.5 mt -101.86 111.52 31.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-O 120.975 0.417 . . . . 0.76 110.936 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.7 p -118.71 -178.93 3.66 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.913 -0.773 . . . . 1.12 108.913 178.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.27 -30.45 60.13 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.288 -0.414 . . . . 1.08 111.739 178.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -64.71 -46.43 82.35 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.949 -0.568 . . . . 0.77 112.313 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 50.4 mp0 -81.88 -25.87 34.66 Favored 'General case' 0 C--N 1.332 -0.165 0 O-C-N 121.903 -0.498 . . . . 0.87 111.095 -177.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.424 HD13 ' CD1' ' B' ' 292' ' ' TRP . 37.5 tp -71.51 -33.55 69.32 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.531 -0.758 . . . . 1.12 110.755 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -91.41 -29.22 12.62 Favored Glycine 0 C--O 1.229 -0.187 0 C-N-CA 120.651 -0.785 . . . . 0.36 113.908 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -60.67 -40.73 93.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 117.354 0.577 . . . . 0.54 112.483 -178.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.3 p -67.5 -48.21 77.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 121.047 -0.261 . . . . 1.97 110.661 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 43.6 mtt -61.24 -36.63 80.49 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.784 0.326 . . . . 1.24 110.432 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 -56.58 -33.29 66.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.243 -0.89 . . . . 2.37 111.639 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 m -112.38 24.79 12.15 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.178 0.513 . . . . 0.99 111.019 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 22.7 tp -125.6 -49.02 1.65 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.031 -0.531 . . . . 1.21 111.124 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -155.5 43.7 0.55 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 121.015 -0.612 . . . . 0.56 112.214 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 71.67 143.32 0.06 Allowed 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.368 0.667 . . . . 3.6 111.165 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -88.05 133.0 38.12 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.703 -0.68 . . . . 0.96 110.822 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -74.54 -177.34 3.28 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.719 2.28 . . . . 0.72 111.307 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.3 p -78.39 165.15 24.15 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.877 -0.329 . . . . 1.09 110.719 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -57.52 -40.88 79.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.895 0.378 . . . . 2.13 110.957 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.07 -45.53 92.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.8 110.809 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -63.41 -36.55 84.12 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.443 -0.799 . . . . 0.81 111.059 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.7 tp -72.36 -38.29 68.6 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.266 -0.425 . . . . 0.94 110.174 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -59.89 -46.2 90.11 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.594 -0.73 . . . . 1.31 110.316 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -64.52 -37.1 86.37 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.498 -0.774 . . . . 1.42 110.792 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 4.1 mmm -63.42 -46.41 86.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.905 -0.588 . . . . 0.78 112.504 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.475 ' O ' HG12 ' A' ' 55' ' ' VAL . 8.4 tp -72.1 -25.97 24.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 120.536 -0.466 . . . . 1.05 110.153 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -75.13 -21.74 58.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.65 0.738 . . . . 1.4 109.667 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.59 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 24.0 tt0 -84.08 -7.09 59.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.855 -1.066 . . . . 1.58 111.058 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.843 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -118.29 -48.95 3.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.451 -0.341 . . . . 1.37 111.234 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -75.01 101.43 4.48 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.781 0.324 . . . . 0.7 110.296 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -7.86 56.09 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.044 -0.526 . . . . 1.17 111.535 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.02 -27.85 39.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.989 0.423 . . . . 0.85 111.094 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 92.99 44.8 3.75 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.681 -0.771 . . . . 1.03 114.705 177.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -144.61 -11.97 0.59 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.282 0.541 . . . . 2.17 111.138 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 75.49 26.08 66.44 Favored Glycine 0 C--N 1.33 0.239 0 C-N-CA 120.701 -0.761 . . . . 0.73 112.582 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 93.8 m -138.89 134.83 33.77 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.097 0.475 . . . . 0.9 110.97 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.473 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 0.4 OUTLIER -119.38 119.31 60.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.553 -0.748 . . . . 0.95 110.313 178.59 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -95.08 -173.17 2.88 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.646 -0.706 . . . . 1.09 110.043 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.513 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 15.1 m-85 -56.6 -52.97 69.4 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.368 -0.378 . . . . 2.05 111.498 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.513 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.7 Cg_endo -54.21 -37.2 87.79 Favored 'Trans proline' 0 C--N 1.364 1.365 0 C-N-CA 122.622 2.215 . . . . 0.85 112.258 178.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -72.95 -46.01 54.83 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.193 0.52 . . . . 0.66 110.481 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -59.29 -37.46 77.74 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.3 -0.864 . . . . 0.91 111.041 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 62.9 mt -59.65 -30.02 68.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.993 -0.549 . . . . 1.23 111.808 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.82 -37.6 10.67 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.194 0.521 . . . . 1.14 110.987 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.501 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 14.4 tpt -59.96 -48.94 79.63 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.596 -0.729 . . . . 1.24 112.102 -179.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.423 ' HE1' ' HB3' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -88.87 26.09 1.63 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.88 0.326 . . . . 0.99 111.88 -178.484 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -132.02 -36.85 1.16 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.998 0.428 . . . . 1.21 111.342 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.234 0.259 0 CA-C-O 120.766 0.317 . . . . 2.96 111.733 -178.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . 0.59 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 110.28 -0.267 . . . . 3.73 110.28 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . . . . . . . . . . . -59.93 -31.32 69.74 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-O 120.715 0.293 . . . . 1.26 110.753 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . 0.502 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -68.57 -14.08 62.77 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 120.844 -0.342 . . . . 1.22 111.435 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . 0.494 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 3.5 m120 -102.68 -38.97 7.25 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.01 0.909 . . . . 0.96 109.292 175.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 1.1 mp -73.57 -10.28 59.55 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.944 -0.571 . . . . 1.85 111.155 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.843 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 2.6 m0 -87.15 -52.66 0.41 Allowed Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 107.766 -1.198 . . . . 0.54 107.766 175.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.502 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 12.8 Cg_exo -51.55 -33.82 49.66 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 123.454 2.77 . . . . 0.58 112.903 174.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.557 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 14.4 t -58.1 -60.11 11.13 Favored Pre-proline 0 CA--C 1.547 0.845 0 CA-C-O 119.203 -0.427 . . . . 1.39 110.903 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.598 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 78.8 Cg_exo -55.61 -34.37 89.94 Favored 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 122.025 1.816 . . . . 0.6 111.887 176.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 9.4 tp -65.35 -33.66 76.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.187 0.517 . . . . 1.08 109.745 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 2.7 ttt -67.84 -32.99 73.9 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.472 -0.936 . . . . 2.31 108.472 177.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 48.5 mm -69.99 -37.2 71.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.343 -0.984 . . . . 1.13 108.343 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . 0.556 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.1 OUTLIER -63.45 -42.23 98.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.169 -0.923 . . . . 1.11 109.264 178.092 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -40.34 94.38 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.258 -0.645 . . . . 2.87 109.258 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 53.7 m -64.54 -39.25 93.41 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.712 -0.676 . . . . 0.91 110.022 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -69.69 -34.61 74.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.086 -0.506 . . . . 2.89 109.89 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -66.44 -28.46 68.62 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.711 0.767 . . . . 1.29 109.503 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -85.5 -36.65 20.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.965 -1.016 . . . . 1.36 109.984 178.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 11.7 m . . . . . 0 C--O 1.255 1.35 0 CA-C-O 118.845 -0.598 . . . . 1.39 110.039 179.083 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 . . . . . 0 C--O 1.234 0.239 0 CA-C-O 120.417 0.151 . . . . 1.18 111.398 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -71.23 -42.68 68.57 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 120.993 0.425 . . . . 1.8 111.537 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 80.1 mttt -68.73 -19.81 64.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.084 -0.507 . . . . 1.39 110.049 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.52 ' HG3' HD11 ' A' ' 18' ' ' LEU . 2.2 tp10 -69.61 -30.79 68.61 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.455 -0.793 . . . . 1.29 110.295 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.493 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -61.04 -46.0 92.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.297 -0.411 . . . . 0.85 110.113 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -84.52 29.29 0.6 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.107 0.48 . . . . 1.25 110.779 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.7 m -137.06 -38.17 0.63 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.947 -0.569 . . . . 0.94 110.712 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.52 HD11 ' HG3' ' A' ' 14' ' ' GLU . 23.3 mt -109.46 -37.91 5.6 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 111.998 0.37 . . . . 0.89 111.998 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.493 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 78.1 t80 -67.26 -43.45 81.83 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.817 0.341 . . . . 1.03 110.396 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -92.29 144.62 25.21 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.002 -0.74 . . . . 0.59 109.002 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -119.37 -2.58 10.58 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.784 -0.367 . . . . 2.09 111.761 -178.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -93.23 -42.0 9.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.034 0.445 . . . . 0.82 110.547 -178.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 119.48 0.49 13.98 Favored Glycine 0 N--CA 1.442 -0.964 0 CA-C-N 115.456 -0.793 . . . . 0.87 111.651 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -75.61 -46.61 30.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.79 0.329 . . . . 0.74 111.155 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.99 26.22 41.96 Favored Glycine 0 CA--C 1.518 0.267 0 CA-C-N 116.264 -0.425 . . . . 1.3 112.295 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.9 152.05 31.34 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 110.4 -0.222 . . . . 1.11 110.4 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.696 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 10.7 mt -94.53 105.83 17.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.395 0.617 . . . . 0.76 110.802 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.86 165.84 17.33 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 114.786 -1.097 . . . . 1.12 109.215 178.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.82 -33.94 51.53 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.239 0.459 . . . . 1.08 112.239 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -61.85 -46.08 91.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.083 -0.508 . . . . 0.77 112.043 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.7 mp0 -77.12 -25.01 51.65 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.886 0.374 . . . . 0.87 110.95 -178.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.444 HD21 ' CE ' ' A' ' 51' ' ' MET . 18.3 tp -76.23 -47.25 24.63 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 116.031 -0.532 . . . . 1.12 110.271 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.99 -36.83 86.96 Favored Glycine 0 C--N 1.333 0.371 0 CA-C-N 115.637 -0.711 . . . . 0.36 114.091 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 p -59.94 -31.49 69.91 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 117.285 0.543 . . . . 0.54 112.406 -178.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.8 t -72.93 -53.42 18.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.811 -0.44 . . . . 1.97 109.811 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.404 ' HE2' ' HE1' ' A' ' 51' ' ' MET . 23.9 mtt -58.73 -41.22 85.89 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.734 -0.666 . . . . 1.24 111.457 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.45 ' HG3' ' HB2' ' A' ' 42' ' ' ASN . 1.1 ttt180 -59.49 -43.06 93.42 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.373 -0.376 . . . . 2.37 111.059 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 69.0 m -85.33 -3.69 58.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.978 0.418 . . . . 0.99 111.848 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.0 tp -100.93 -62.13 1.28 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.806 0.336 . . . . 1.21 111.295 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -149.08 62.97 0.41 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.528 -0.844 . . . . 0.56 112.726 -178.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 69.5 158.64 0.17 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.579 0.704 . . . . 3.6 112.043 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.45 ' HB2' ' HG3' ' A' ' 37' ' ' ARG . 3.9 t30 -105.94 135.01 19.48 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.838 -0.619 . . . . 0.96 110.57 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -75.95 -168.04 0.51 Allowed 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.344 2.029 . . . . 0.72 111.45 178.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.5 p -80.39 165.92 21.77 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 110.311 -0.255 . . . . 1.09 110.311 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -65.19 -32.72 74.54 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.556 -0.535 . . . . 2.13 109.556 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.5 -50.09 71.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.726 -0.67 . . . . 0.8 110.15 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -64.92 -33.94 77.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.774 -0.648 . . . . 0.81 110.606 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 47.8 tp -62.81 -38.35 90.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.467 -0.788 . . . . 0.94 110.358 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.526 ' O ' HG22 ' A' ' 52' ' ' ILE . 6.6 tt0 -77.74 -42.07 35.53 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.885 -0.598 . . . . 1.31 110.123 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -59.51 -29.41 67.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.189 0.518 . . . . 1.42 110.455 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.464 ' SD ' ' HA ' ' B' ' 288' ' ' ALA . 1.7 mmm -69.21 -35.38 76.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.916 -0.584 . . . . 0.78 110.853 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.526 HG22 ' O ' ' A' ' 49' ' ' GLN . 5.0 tp -80.85 -13.09 12.8 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-O 121.467 0.651 . . . . 1.05 109.546 179.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -81.16 -27.18 35.54 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.497 -0.774 . . . . 1.4 109.32 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.598 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 22.3 tt0 -94.41 36.37 1.16 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.584 -0.734 . . . . 1.58 110.274 178.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.766 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 7.1 p -164.59 -32.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 C-N-CA 119.965 -0.694 . . . . 1.37 112.592 -177.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -93.09 80.13 4.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.99 0.424 . . . . 0.7 110.303 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.72 -28.46 61.05 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.55 -0.75 . . . . 1.17 112.791 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -69.48 -14.48 62.9 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.881 0.372 . . . . 0.85 110.828 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.55 51.48 58.47 Favored Glycine 0 C--N 1.333 0.373 0 CA-C-N 116.277 -0.42 . . . . 1.03 113.044 178.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -124.29 -25.7 4.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.17 0.51 . . . . 2.17 110.376 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.2 14.59 47.83 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.799 -0.637 . . . . 0.73 111.891 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.5 m -152.42 139.06 18.75 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 120.995 0.426 . . . . 0.9 111.379 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.494 HD11 ' CH2' ' B' ' 292' ' ' TRP . 0.4 OUTLIER -116.13 118.52 59.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 108.737 -0.838 . . . . 0.95 108.737 178.347 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -91.81 -172.39 3.18 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.645 -0.502 . . . . 1.09 109.645 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.49 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 31.0 m-85 -55.88 -53.92 57.8 Favored Pre-proline 0 CA--C 1.532 0.263 0 O-C-N 123.085 0.24 . . . . 2.05 111.17 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.7 Cg_endo -50.93 -43.18 48.86 Favored 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 122.236 1.957 . . . . 0.85 112.02 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.415 ' OE1' ' HA ' ' A' ' 63' ' ' ILE . 20.2 mt-10 -69.69 -43.22 72.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.362 -0.381 . . . . 0.66 110.759 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -56.77 -40.98 76.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.833 -0.621 . . . . 0.91 111.335 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.29 -34.75 77.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.686 -0.688 . . . . 1.23 110.7 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.7 m -81.79 -41.82 20.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.132 -0.485 . . . . 1.14 111.137 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.486 ' HE1' ' HA ' ' B' ' 289' ' ' ALA . 5.6 tpt -61.92 -50.09 73.58 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.516 0.562 . . . . 1.24 112.516 -178.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.67 -15.1 61.71 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.12 -0.632 . . . . 0.99 112.367 -178.162 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -96.69 -13.16 22.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.141 0.496 . . . . 1.21 110.262 178.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.331 -0.227 0 CA-C-N 115.741 -0.663 . . . . 2.96 110.307 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . 0.598 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 5.2 ttm180 . . . . . 0 N--CA 1.477 0.899 0 CA-C-O 120.718 0.294 . . . . 3.73 110.556 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . 0.655 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -63.21 -31.61 72.8 Favored 'General case' 0 C--O 1.216 -0.709 0 N-CA-C 112.621 0.6 . . . . 1.26 112.621 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . 0.519 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -63.64 -3.52 2.31 Favored 'General case' 0 C--O 1.216 -0.658 0 N-CA-C 113.335 0.865 . . . . 1.22 113.335 -179.394 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -111.42 -35.97 5.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 122.286 1.041 . . . . 0.96 109.973 177.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . 0.4 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 8.2 mp -80.22 -8.36 59.41 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 114.077 -1.419 . . . . 1.85 109.979 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.766 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 6.5 m0 -90.72 -54.56 0.28 Allowed Pre-proline 0 CA--C 1.535 0.394 0 N-CA-C 107.176 -1.416 . . . . 0.54 107.176 175.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.519 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 21.4 Cg_exo -50.77 -32.81 38.16 Favored 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 122.751 2.301 . . . . 0.58 112.571 174.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.539 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 19.5 t -59.78 -61.76 7.24 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-O 119.124 -0.465 . . . . 1.39 110.688 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.539 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 93.1 Cg_exo -52.06 -36.23 64.77 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 121.594 1.529 . . . . 0.6 112.215 176.221 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 14.2 tp -65.21 -32.68 74.48 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.347 0.594 . . . . 1.08 109.735 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 17.7 ttt -73.31 -45.36 55.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.208 -0.906 . . . . 2.31 108.926 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 46.2 mm -61.1 -33.65 56.92 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 N-CA-C 108.881 -0.785 . . . . 1.13 108.881 178.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . 0.553 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.2 OUTLIER -62.95 -43.85 97.65 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.18 -0.918 . . . . 1.11 109.105 178.21 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -41.62 89.7 Favored 'General case' 0 C--N 1.333 -0.113 0 N-CA-C 108.945 -0.761 . . . . 2.87 108.945 178.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 67.9 m -65.01 -42.86 94.06 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.619 -0.719 . . . . 0.91 110.676 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 22.5 tptp -67.49 -36.24 80.72 Favored 'General case' 0 C--O 1.225 -0.219 0 N-CA-C 110.014 -0.365 . . . . 2.89 110.014 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 3.2 tttp -63.48 -30.45 71.57 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.942 -0.762 . . . . 1.29 108.942 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -82.07 -31.59 30.74 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.099 -0.955 . . . . 1.36 109.907 178.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.8 m . . . . . 0 C--O 1.247 0.926 0 CA-C-N 115.453 -0.794 . . . . 1.39 111.216 179.827 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.236 0.373 0 CA-C-O 121.016 0.436 . . . . 1.18 110.063 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -69.25 -32.72 72.13 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.439 0.637 . . . . 1.8 109.317 178.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -70.34 -20.23 63.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.294 -0.866 . . . . 1.39 111.202 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.508 ' HG3' HD11 ' A' ' 18' ' ' LEU . 3.7 tp10 -66.94 -24.61 66.1 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 109.181 -0.674 . . . . 1.29 109.181 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.419 ' O ' ' HB2' ' A' ' 19' ' ' PHE . . . -69.28 -37.42 77.85 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.743 -0.466 . . . . 0.85 109.743 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -86.59 14.98 6.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.883 0.373 . . . . 1.25 110.754 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.3 m -129.03 -35.45 1.84 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.952 0.406 . . . . 0.94 110.914 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.508 HD11 ' HG3' ' A' ' 14' ' ' GLU . 44.6 mt -99.37 -28.55 13.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.277 -0.419 . . . . 0.89 111.938 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.419 ' HB2' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -80.93 -57.6 3.47 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.225 0.536 . . . . 1.03 110.005 -179.012 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -82.4 142.0 32.32 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.004 -0.998 . . . . 0.59 111.146 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -128.89 6.8 5.53 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.104 -0.702 . . . . 2.09 109.104 178.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -95.08 -25.72 16.34 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.849 -0.614 . . . . 0.82 111.643 -178.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.05 22.14 23.64 Favored Glycine 0 N--CA 1.442 -0.914 0 N-CA-C 110.709 -0.956 . . . . 0.87 110.709 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -95.8 -32.8 12.52 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.641 -0.503 . . . . 0.74 109.641 179.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.16 28.74 73.82 Favored Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.863 -0.684 . . . . 1.3 112.878 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.5 p -132.35 128.16 37.06 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 122.932 -0.158 . . . . 1.11 111.227 -179.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.575 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 47.9 mt -75.14 112.19 12.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 120.97 0.414 . . . . 0.76 111.379 -179.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.5 p -117.8 177.87 4.61 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.417 -0.811 . . . . 1.12 108.815 178.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.423 HG21 ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -58.02 -28.24 64.27 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.779 0.323 . . . . 1.08 111.143 178.207 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 44.6 tttt -65.88 -44.63 84.78 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 112.175 0.435 . . . . 0.77 112.175 -179.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.3 mp0 -78.98 -22.03 46.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.95 0.405 . . . . 0.87 111.143 -178.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.4 tp -83.46 -38.66 21.55 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.096 -0.502 . . . . 1.12 110.748 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.18 -32.75 51.45 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.736 -0.745 . . . . 0.36 113.619 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -60.41 -44.91 95.25 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.272 0.471 . . . . 0.54 112.272 -178.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.5 p -66.5 -48.33 80.9 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 120.978 -0.289 . . . . 1.97 110.734 -178.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 56.6 mtt -56.56 -46.38 80.75 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.718 0.294 . . . . 1.24 111.538 178.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -58.39 -29.5 66.09 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.172 -0.467 . . . . 2.37 111.313 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.0 m -99.05 3.88 46.92 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.13 -0.486 . . . . 0.99 111.337 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.5 tp -113.97 -34.14 5.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.314 -0.403 . . . . 1.21 111.408 -178.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -169.3 53.23 0.21 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.225 -0.988 . . . . 0.56 112.829 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 72.89 175.9 0.27 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.495 0.664 . . . . 3.6 111.894 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -116.76 123.72 30.07 Favored Pre-proline 0 C--N 1.318 -0.791 0 CA-C-N 115.273 -0.876 . . . . 0.96 109.56 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -77.48 -163.92 0.24 Allowed 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.162 1.908 . . . . 0.72 111.106 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.6 p -82.55 158.97 22.91 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.01 -0.676 . . . . 1.09 110.195 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.3 mp0 -57.15 -35.28 69.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.97 -0.559 . . . . 2.13 110.533 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.3 -46.14 91.54 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.425 0.631 . . . . 0.8 110.165 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -64.96 -41.11 95.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.216 -0.902 . . . . 0.81 110.37 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.423 ' HG ' HG21 ' A' ' 29' ' ' THR . 18.9 tp -65.05 -43.08 93.48 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.738 -0.664 . . . . 0.94 110.216 179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -66.59 -46.76 74.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.288 -0.415 . . . . 1.31 110.66 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -56.18 -35.5 67.31 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.044 0.45 . . . . 1.42 110.741 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.447 ' SD ' HD11 ' B' ' 291' ' ' LEU . 2.9 mmm -66.72 -45.96 77.01 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.504 -0.771 . . . . 0.78 111.265 -179.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.456 ' O ' HG12 ' A' ' 55' ' ' VAL . 8.9 tp -69.5 -22.99 25.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-O 121.096 0.474 . . . . 1.05 110.251 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.54 -24.97 41.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.675 0.75 . . . . 1.4 109.193 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.409 ' HB3' ' HB2' ' B' ' 288' ' ' ALA . 9.1 tp10 -77.41 -9.54 58.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.01 -0.995 . . . . 1.58 110.372 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.803 HG23 ' CZ2' ' B' ' 292' ' ' TRP . 0.7 OUTLIER -118.9 -49.72 3.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.292 -0.413 . . . . 1.37 111.849 -179.699 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -79.4 103.8 9.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 0.7 110.841 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.32 -25.69 46.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.867 -0.606 . . . . 1.17 112.598 -178.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -64.14 -39.25 93.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.683 -0.235 . . . . 0.85 111.419 -179.031 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 101.99 31.21 5.46 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.38 -0.914 . . . . 1.03 113.332 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -127.86 -6.04 5.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.84 0.352 . . . . 2.17 110.807 179.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.48 34.69 88.51 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.663 -0.779 . . . . 0.73 112.252 179.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.7 m -142.74 131.69 22.96 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 110.014 -0.365 . . . . 0.9 110.014 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.513 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 0.1 OUTLIER -113.35 121.71 66.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.141 0.496 . . . . 0.95 111.16 179.662 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -92.43 -176.96 4.47 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.488 -0.778 . . . . 1.09 110.747 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.504 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 36.1 m-85 -52.92 -54.9 38.7 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 116.467 -0.333 . . . . 2.05 111.788 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.407 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.8 Cg_endo -59.13 -32.57 97.47 Favored 'Trans proline' 0 C--N 1.36 1.152 0 C-N-CA 122.121 1.881 . . . . 0.85 113.674 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -70.39 -42.88 71.12 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.252 0.549 . . . . 0.66 110.296 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -66.68 -44.34 82.01 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.584 -0.734 . . . . 0.91 110.73 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 81.4 mt -59.73 -29.62 68.26 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.427 -0.352 . . . . 1.23 111.409 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.7 m -81.92 -44.6 16.58 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.097 0.406 . . . . 1.14 112.097 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.648 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 24.5 ttt -67.27 -49.73 63.22 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.676 0.621 . . . . 1.24 112.676 -178.235 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.409 ' HE1' ' HB3' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -74.34 3.45 7.35 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.892 0.701 . . . . 0.99 112.892 -178.122 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -115.44 -11.08 11.88 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.257 0.551 . . . . 1.21 109.997 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.509 0 CA-C-N 115.473 -0.785 . . . . 2.96 110.173 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . 0.415 ' HB3' ' OD1' ' B' ' 290' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 109.488 -0.56 . . . . 3.73 109.488 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . 0.409 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . . . -72.25 -24.8 61.42 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-O 121.232 0.539 . . . . 1.26 110.975 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . 0.648 ' HA ' ' CE ' ' A' ' 71' ' ' MET . . . -68.53 -0.55 5.21 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.219 0.822 . . . . 1.22 113.219 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . 0.513 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 2.9 m120 -114.38 -36.47 4.63 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 123.233 1.492 . . . . 0.96 109.745 176.105 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . 0.447 HD11 ' SD ' ' A' ' 51' ' ' MET . 6.4 mt -80.82 -3.06 49.76 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 113.018 -1.901 . . . . 1.85 111.156 -178.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.803 ' CZ2' HG23 ' A' ' 55' ' ' VAL . 3.1 m0 -100.04 -52.7 0.18 Allowed Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 107.449 -1.315 . . . . 0.54 107.449 174.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.575 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 11.6 Cg_exo -49.54 -39.05 45.75 Favored 'Trans proline' 0 C--N 1.376 1.978 0 C-N-CA 122.969 2.446 . . . . 0.58 111.545 175.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.43 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 3.1 t -60.83 -64.05 3.58 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 108.617 -0.883 . . . . 1.39 108.617 177.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.43 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 2.8 Cg_exo -47.3 -36.17 22.16 Favored 'Trans proline' 0 C--N 1.359 1.11 0 C-N-CA 122.599 2.2 . . . . 0.6 112.834 174.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 13.0 tp -70.85 -37.49 73.14 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 120.725 0.298 . . . . 1.08 110.528 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 14.6 ttt -65.08 -36.25 83.74 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.522 -0.918 . . . . 2.31 108.522 178.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 30.9 mm -66.07 -37.52 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-N 114.776 -1.102 . . . . 1.13 108.434 176.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . 0.519 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.2 OUTLIER -65.08 -40.99 95.44 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 108.684 -0.858 . . . . 1.11 108.684 177.355 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 16.9 mtp180 -61.91 -38.69 89.33 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.04 -0.726 . . . . 2.87 109.04 178.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 67.2 m -64.03 -45.21 89.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.562 -0.745 . . . . 0.91 110.339 178.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 15.6 tptp -68.56 -30.6 69.41 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.101 0.476 . . . . 2.89 109.863 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 6.1 tttp -68.2 -31.23 70.61 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.896 0.855 . . . . 1.29 108.796 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -77.41 -40.05 44.92 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.66 -1.155 . . . . 1.36 108.932 177.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 C--O 1.247 0.963 0 CA-C-N 115.61 -0.723 . . . . 1.39 111.025 178.836 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.413 ' CD ' ' HZ3' ' B' ' 299' ' ' LYS . 1.2 mm-40 . . . . . 0 C--O 1.237 0.434 0 CA-C-O 120.85 0.357 . . . . 1.18 110.734 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -72.38 -36.62 68.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.841 -0.618 . . . . 1.8 109.79 178.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -67.89 -26.4 65.98 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.824 -0.626 . . . . 1.39 110.227 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.489 ' HG2' ' HE3' ' B' ' 299' ' ' LYS . 4.9 tp10 -60.78 -33.63 73.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.54 -0.754 . . . . 1.29 109.939 178.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.01 -41.5 99.57 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.921 -0.581 . . . . 0.85 109.741 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -77.1 3.03 13.44 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.214 -0.448 . . . . 1.25 111.56 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 7.5 m -117.54 -36.98 3.56 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.194 -0.457 . . . . 0.94 111.486 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.458 HD11 ' HG3' ' A' ' 14' ' ' GLU . 89.1 mt -96.3 -20.09 18.78 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.102 0.408 . . . . 0.89 112.102 -179.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -85.86 -53.62 5.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.9 0.381 . . . . 1.03 110.216 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -83.06 142.58 31.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.481 -0.781 . . . . 0.59 111.631 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.8 mptt -127.77 -10.06 5.54 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.999 -0.546 . . . . 2.09 110.622 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.81 -41.46 30.2 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 120.983 0.421 . . . . 0.82 110.198 -178.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 115.94 1.62 20.81 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 111.187 -0.765 . . . . 0.87 111.187 -178.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -72.47 -36.09 68.38 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.885 -0.413 . . . . 0.74 109.885 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.54 35.78 62.74 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.871 -0.68 . . . . 1.3 112.467 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.76 145.7 38.59 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 110.273 -0.269 . . . . 1.11 110.273 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.623 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 65.1 mt -87.91 111.29 21.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 C-N-CA 120.661 -0.416 . . . . 0.76 110.793 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.3 p -123.65 -177.5 3.75 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.777 -0.823 . . . . 1.12 108.777 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.75 -30.94 66.0 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.474 0.546 . . . . 1.08 112.474 179.015 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -64.32 -48.23 76.41 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.03 0.752 . . . . 0.77 113.03 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.1 mp0 -79.31 -22.52 44.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.449 0.642 . . . . 0.87 110.954 -177.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.454 HD23 ' HE3' ' A' ' 51' ' ' MET . 35.8 tp -74.33 -35.97 63.64 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.2 -0.909 . . . . 1.12 110.742 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -88.26 -29.17 20.55 Favored Glycine 0 CA--C 1.518 0.246 0 C-N-CA 120.786 -0.721 . . . . 0.36 113.099 -179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -60.78 -40.97 94.56 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.944 0.372 . . . . 0.54 111.541 -178.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.577 HG13 ' N ' ' A' ' 36' ' ' MET . 14.5 p -68.96 -48.29 71.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.523 -0.308 . . . . 1.97 110.403 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.577 ' N ' HG13 ' A' ' 35' ' ' VAL . 61.6 mtt -60.22 -42.27 94.81 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.675 -0.239 . . . . 1.24 111.267 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -35.07 74.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.306 -0.406 . . . . 2.37 110.769 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.7 m -91.09 0.35 57.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.259 -0.428 . . . . 0.99 111.367 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.3 tp -103.92 -57.89 1.96 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.782 0.325 . . . . 1.21 110.983 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -151.19 45.67 0.63 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.675 -0.774 . . . . 0.56 111.899 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 71.21 155.96 0.15 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.423 0.689 . . . . 3.6 110.984 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -106.6 138.0 19.63 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.25 -0.432 . . . . 0.96 110.853 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.38 -164.45 0.16 Allowed 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 122.572 2.181 . . . . 0.72 111.421 178.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.1 p -75.86 163.51 27.15 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.835 -0.346 . . . . 1.09 110.363 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -62.96 -30.45 71.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.045 -0.525 . . . . 2.13 110.963 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.87 -42.61 99.83 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.151 0.5 . . . . 0.8 110.667 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -71.56 -36.28 70.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.776 -0.647 . . . . 0.81 110.107 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 59.6 tp -64.14 -45.76 87.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.619 -0.718 . . . . 0.94 110.381 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -69.11 -32.13 71.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.952 0.405 . . . . 1.31 110.829 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -69.71 -38.98 77.13 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.302 -0.408 . . . . 1.42 110.155 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.454 ' HE3' HD23 ' A' ' 32' ' ' LEU . 4.9 mmm -57.5 -46.35 83.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.72 -0.673 . . . . 0.78 112.125 -179.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.404 ' HA ' ' CG1' ' A' ' 55' ' ' VAL . 8.8 tp -69.16 -22.44 26.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 120.603 -0.439 . . . . 1.05 111.263 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -22.83 51.83 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.212 0.53 . . . . 1.4 109.6 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.59 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 7.3 tt0 -82.36 -18.73 41.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.678 -0.692 . . . . 1.58 110.665 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.862 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -103.72 -48.33 10.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.153 0.427 . . . . 1.37 112.153 -179.71 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -83.35 106.01 14.77 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.274 0.559 . . . . 0.7 110.932 -179.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.2 -20.4 28.6 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.503 -0.771 . . . . 1.17 112.057 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.34 -29.43 69.62 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 110.037 -0.357 . . . . 0.85 110.037 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 91.41 34.15 7.63 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.77 -0.729 . . . . 1.03 114.11 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -129.65 -5.96 4.64 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 122.512 -0.405 . . . . 2.17 110.187 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.11 13.57 64.73 Favored Glycine 0 C--N 1.336 0.57 0 C-N-CA 121.282 -0.485 . . . . 0.73 112.954 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 3.9 m -119.04 130.07 55.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.751 0.31 . . . . 0.9 110.51 -179.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.58 HD11 ' CH2' ' B' ' 292' ' ' TRP . 0.4 OUTLIER -121.21 120.0 60.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.962 -0.563 . . . . 0.95 110.685 178.96 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -99.2 -172.91 2.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.164 -0.925 . . . . 1.09 109.955 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.524 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 4.3 m-85 -54.07 -54.97 41.39 Favored Pre-proline 0 N--CA 1.466 0.366 0 C-N-CA 122.549 0.339 . . . . 2.05 111.593 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.8 Cg_endo -52.13 -42.13 61.06 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 122.684 2.256 . . . . 0.85 112.775 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -69.0 -48.08 63.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.66 110.373 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -58.58 -47.42 84.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.511 -0.768 . . . . 0.91 111.75 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 70.2 mt -59.3 -26.75 65.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.209 -0.45 . . . . 1.23 111.811 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.5 m -93.55 -36.42 12.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.523 -0.308 . . . . 1.14 110.995 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.436 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 6.5 tpt -62.63 -47.94 81.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 1.24 111.47 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.26 2.88 6.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.102 -0.499 . . . . 0.99 111.3 -179.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -119.8 11.88 11.99 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.212 0.53 . . . . 1.21 110.364 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.2 mmm180 . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.8 -0.636 . . . . 2.96 110.858 -179.833 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . 0.59 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 1.5 ttm180 . . . . . 0 N--CA 1.479 1.005 0 N-CA-C 109.833 -0.432 . . . . 3.73 109.833 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . . . . . . . . . . . -57.95 -30.57 66.08 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 113.148 0.796 . . . . 1.26 113.148 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . 0.697 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -67.67 -15.27 63.56 Favored 'General case' 0 C--O 1.201 -1.478 0 CA-C-O 118.728 -0.653 . . . . 1.22 109.838 -178.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -98.45 -40.34 8.32 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 118.477 0.58 . . . . 0.96 110.884 174.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 9.0 mp -75.2 -9.91 58.98 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 115.545 -0.752 . . . . 1.85 111.263 -179.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.862 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 2.2 m95 -88.92 -54.59 0.32 Allowed Pre-proline 0 C--N 1.321 -0.638 0 N-CA-C 107.601 -1.259 . . . . 0.54 107.601 175.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.697 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 6.6 Cg_exo -48.02 -36.76 28.6 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 123.653 2.902 . . . . 0.58 113.141 174.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.503 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 12.5 t -59.39 -62.03 6.67 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 119.126 -0.464 . . . . 1.39 111.332 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.503 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 92.7 Cg_exo -51.33 -35.87 55.48 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 122.016 1.811 . . . . 0.6 112.178 176.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 46.3 tp -66.95 -38.44 86.12 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.719 -0.474 . . . . 1.08 109.719 178.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 27.5 ttt -63.53 -37.07 85.91 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.52 -0.919 . . . . 2.31 108.52 177.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 44.0 mm -64.33 -38.99 83.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 108.379 -0.971 . . . . 1.13 108.379 177.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . 0.489 ' HE3' ' HG2' ' A' ' 14' ' ' GLU . 0.1 OUTLIER -62.16 -44.17 97.21 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.866 -0.606 . . . . 1.11 109.474 178.087 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -62.83 -38.2 89.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.743 -0.662 . . . . 2.87 109.769 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 22.7 m -67.75 -33.89 75.74 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.929 -0.578 . . . . 0.91 109.833 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -77.27 -29.68 54.01 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.14 -0.689 . . . . 2.89 109.14 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . 0.482 ' HG3' ' HG2' ' A' ' 14' ' ' GLU . 0.9 OUTLIER -70.51 -33.73 71.53 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 108.404 -0.962 . . . . 1.29 108.404 178.893 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -77.62 -40.54 41.61 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.34 -0.985 . . . . 1.36 108.34 177.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 3.5 m . . . . . 0 C--O 1.251 1.172 0 CA-C-N 115.768 -0.651 . . . . 1.39 111.221 177.858 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 C--O 1.234 0.251 0 CA-C-O 121.538 0.685 . . . . 1.18 109.781 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -76.36 -35.06 58.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.319 -0.855 . . . . 1.8 109.758 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.594 ' HA ' ' CD2' ' A' ' 16' ' ' PHE . 81.6 mttt -66.21 -28.85 69.06 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.498 0.666 . . . . 1.39 109.427 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.474 ' HB3' ' HZ2' ' B' ' 299' ' ' LYS . 3.8 tp10 -60.0 -36.81 78.0 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.775 -1.102 . . . . 1.29 110.851 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.449 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -64.49 -39.19 93.33 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.939 -0.573 . . . . 0.85 111.011 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.594 ' CD2' ' HA ' ' A' ' 13' ' ' LYS . 9.7 m-85 -65.75 -14.0 60.46 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.704 0.288 . . . . 1.25 111.444 -179.282 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 42.5 m -110.71 -36.03 5.83 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.382 0.512 . . . . 0.94 112.382 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.0 mt -91.93 -22.93 19.77 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.337 0.495 . . . . 0.89 112.337 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.449 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 84.8 t80 -91.55 -50.01 6.0 Favored 'General case' 0 C--N 1.327 -0.38 0 O-C-N 122.353 -0.217 . . . . 1.03 110.622 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -80.46 148.52 30.45 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.384 -0.371 . . . . 0.59 111.099 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -130.61 15.04 5.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.32 -0.4 . . . . 2.09 111.361 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -108.94 -38.34 5.61 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.063 0.459 . . . . 0.82 110.525 -178.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 122.64 -13.15 8.75 Favored Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 111.109 -0.797 . . . . 0.87 111.109 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -69.1 -39.52 78.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.424 -0.388 . . . . 0.74 110.986 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 75.18 24.96 69.88 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.873 -0.68 . . . . 1.3 112.903 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.489 HG21 ' HA ' ' A' ' 64' ' ' ASP . 22.5 p -119.7 156.26 30.83 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.935 0.368 . . . . 1.11 110.727 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.791 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 55.7 mt -96.14 108.35 21.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.027 0.441 . . . . 0.76 111.36 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.68 175.9 6.0 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.425 -0.807 . . . . 1.12 109.592 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.449 HG23 ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -53.43 -41.81 66.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.234 0.54 . . . . 1.08 111.892 179.916 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -58.03 -53.3 59.76 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.343 -0.844 . . . . 0.77 113.269 -178.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 18.4 mp0 -75.73 -23.49 56.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.679 0.276 . . . . 0.87 111.716 -177.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.465 HD11 ' CD1' ' B' ' 292' ' ' TRP . 14.4 tp -69.93 -49.98 46.6 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.05 -0.523 . . . . 1.12 109.966 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.563 ' O ' ' HB2' ' A' ' 37' ' ' ARG . . . -71.68 -36.91 61.83 Favored Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 115.47 -0.786 . . . . 0.36 113.634 -178.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.62 -41.23 89.94 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 117.825 0.813 . . . . 0.54 112.232 -178.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 72.7 t -71.93 -57.02 8.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.666 0.27 . . . . 1.97 110.918 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 36.3 mtt -58.43 -27.56 64.44 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.396 -0.365 . . . . 1.24 111.517 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.563 ' HB2' ' O ' ' A' ' 33' ' ' GLY . 43.6 ttt180 -62.97 -32.69 74.07 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.986 -0.552 . . . . 2.37 111.158 178.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.5 m -94.3 -3.98 49.54 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.955 -0.566 . . . . 0.99 111.373 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.4 tp -95.33 -42.35 8.56 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.251 -0.431 . . . . 1.21 110.858 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . 0.455 ' O ' ' HB2' ' A' ' 41' ' ' GLN . . . -163.31 38.35 0.33 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.699 -0.763 . . . . 0.56 112.163 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.455 ' HB2' ' O ' ' A' ' 40' ' ' GLY . 1.2 mp0 71.79 154.01 0.13 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.449 0.642 . . . . 3.6 111.644 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -119.28 139.24 27.32 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.034 -0.53 . . . . 0.96 110.117 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -77.12 -157.76 0.07 OUTLIER 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.312 2.008 . . . . 0.72 113.045 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.0 p -77.73 160.85 28.15 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 122.045 -0.409 . . . . 1.09 111.911 -178.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -54.71 -31.53 58.28 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.744 -0.662 . . . . 2.13 110.865 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.4 -54.22 40.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 0.8 110.597 179.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -64.19 -34.02 77.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.746 -0.661 . . . . 0.81 110.515 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.449 ' HG ' HG23 ' A' ' 29' ' ' THR . 46.6 tp -67.71 -41.61 83.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.671 -0.695 . . . . 0.94 110.747 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.521 ' O ' HG22 ' A' ' 52' ' ' ILE . 23.0 tt0 -67.35 -32.23 73.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.169 -0.469 . . . . 1.31 110.144 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -66.87 -32.36 73.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.203 0.525 . . . . 1.42 109.922 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.438 ' HE3' HD22 ' A' ' 32' ' ' LEU . 1.4 mmm -64.61 -38.78 92.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.425 -0.807 . . . . 0.78 111.276 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.521 HG22 ' O ' ' A' ' 49' ' ' GLN . 6.9 tp -75.89 -12.64 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.152 0.501 . . . . 1.05 110.914 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -85.44 -21.75 28.6 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.932 -0.766 . . . . 1.4 108.932 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.664 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 11.4 tt0 -89.76 16.8 7.37 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.384 -1.28 . . . . 1.58 110.572 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.786 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 6.6 p -146.82 -38.6 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 120.094 -0.642 . . . . 1.37 112.557 -177.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -85.79 98.49 10.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.319 0.58 . . . . 0.7 109.716 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.4 -19.77 29.21 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 113.018 0.747 . . . . 1.17 113.018 -177.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -71.4 -36.62 71.44 Favored 'General case' 0 C--N 1.327 -0.39 0 O-C-N 122.444 -0.16 . . . . 0.85 110.821 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 101.25 49.0 1.37 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.204 -0.998 . . . . 1.03 113.839 178.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 27.0 p-10 -135.31 -14.53 1.98 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 117.111 0.456 . . . . 2.17 110.531 178.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 72.69 24.84 75.41 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 121.087 -0.577 . . . . 0.73 112.63 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 18.4 m -155.35 126.72 7.26 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.78 -0.452 . . . . 0.9 109.78 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.443 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 0.6 OUTLIER -100.47 108.85 23.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 120.456 -0.498 . . . . 0.95 110.479 179.829 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.489 ' HA ' HG21 ' A' ' 26' ' ' THR . 28.5 t0 -83.17 175.04 10.26 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.097 -0.956 . . . . 1.09 110.052 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.437 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 4.5 m-85 -46.17 -53.69 21.25 Favored Pre-proline 0 CA--C 1.544 0.725 0 N-CA-C 112.915 0.709 . . . . 2.05 112.915 -178.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.437 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 19.7 Cg_endo -59.14 -38.56 85.84 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 122.138 1.892 . . . . 0.85 112.866 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -66.53 -40.38 89.1 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.187 0.518 . . . . 0.66 110.257 -179.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -63.38 -36.33 83.35 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.45 -0.795 . . . . 0.91 110.903 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.5 mt -62.34 -23.37 66.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.181 -0.463 . . . . 1.23 111.693 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.11 -40.42 9.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.192 0.52 . . . . 1.14 110.508 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.568 ' HE2' ' HA ' ' B' ' 289' ' ' ALA . 10.9 tpt -54.84 -48.83 72.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.264 -0.88 . . . . 1.24 111.803 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.413 ' SD ' ' HG3' ' A' ' 71' ' ' MET . 0.1 OUTLIER -89.8 22.93 2.9 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 122.241 -0.287 . . . . 0.99 111.77 -179.442 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.09 -41.81 1.11 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.298 0.571 . . . . 1.21 111.454 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? . . . . . 0 C--N 1.321 -0.665 0 CA-C-N 116.016 -0.538 . . . . 2.96 110.829 -179.47 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . 0.664 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 1.4 tpm_? . . . . . 0 N--CA 1.479 0.978 0 N-CA-C 110.564 -0.162 . . . . 3.73 110.564 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . 0.664 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -58.44 -30.91 67.28 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 120.801 0.334 . . . . 1.26 111.39 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . 0.704 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -70.44 -12.21 61.42 Favored 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 116.05 -0.523 . . . . 1.22 111.316 -178.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . 0.453 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 14.8 m120 -99.87 -40.86 7.48 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-O 121.76 0.791 . . . . 0.96 110.033 173.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . 0.583 ' O ' ' HB2' ' B' ' 294' ' ' SER . 5.7 mt -66.38 -44.54 82.85 Favored 'General case' 0 C--O 1.206 -1.211 0 CA-C-N 114.77 -1.105 . . . . 1.85 109.42 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.791 ' CZ2' HG21 ' A' ' 27' ' ' ILE . 10.3 m0 -56.29 -53.92 58.56 Favored Pre-proline 0 N--CA 1.467 0.411 0 N-CA-C 109.519 -0.549 . . . . 0.54 109.519 177.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.704 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 13.1 Cg_exo -47.79 -31.56 15.24 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 122.673 2.248 . . . . 0.58 112.951 175.205 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.583 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 6.0 m -58.05 -65.0 2.11 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-O 118.459 -0.781 . . . . 1.39 110.847 178.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.555 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 86.9 Cg_exo -52.56 -33.75 59.65 Favored 'Trans proline' 0 C--N 1.369 1.65 0 C-N-CA 121.62 1.547 . . . . 0.6 112.884 176.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 10.7 tp -67.09 -38.79 86.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.234 0.54 . . . . 1.08 109.609 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 24.8 ttt -67.47 -38.93 85.15 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.715 -0.846 . . . . 2.31 108.715 178.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . 0.459 HG12 ' O ' ' B' ' 294' ' ' SER . 18.3 mm -66.91 -36.2 76.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.021 -0.991 . . . . 1.13 108.689 177.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . 0.474 ' HZ2' ' HB3' ' A' ' 14' ' ' GLU . 0.1 OUTLIER -63.75 -35.75 81.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.698 -0.683 . . . . 1.11 109.419 178.199 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 2.4 mmt180 -68.12 -38.4 82.18 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.855 -0.611 . . . . 2.87 109.583 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 28.6 m -69.62 -33.74 73.09 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.54 -0.754 . . . . 0.91 110.401 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -77.11 -32.83 56.83 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.292 -0.632 . . . . 2.89 109.292 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.5 -33.2 74.61 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.705 -0.68 . . . . 1.29 109.202 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -77.88 -35.96 50.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.254 -0.885 . . . . 1.36 109.941 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.5 t . . . . . 0 C--O 1.252 1.201 0 CA-C-O 118.108 -0.949 . . . . 1.39 110.301 179.662 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.44 ' CD ' ' HZ2' ' B' ' 299' ' ' LYS . 1.2 tm-20 . . . . . 0 N--CA 1.453 -0.298 0 CA-C-O 120.908 0.385 . . . . 1.18 110.315 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.1 m-30 -70.93 -37.27 72.88 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.068 -0.514 . . . . 1.8 110.45 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -64.71 -32.99 74.92 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 121.61 0.719 . . . . 1.39 110.046 179.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.485 ' HA ' ' OE1' ' A' ' 14' ' ' GLU . 1.4 tp10 -59.64 -32.28 70.29 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.459 -0.791 . . . . 1.29 110.639 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.31 -45.76 86.53 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.147 -0.479 . . . . 0.85 110.738 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -82.1 12.23 4.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.799 0.333 . . . . 1.25 111.808 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.8 m -123.05 -44.27 2.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.365 -0.38 . . . . 0.94 111.019 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.463 ' HB2' ' CG ' ' B' ' 299' ' ' LYS . 92.4 mt -88.98 -31.85 17.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.826 0.346 . . . . 0.89 111.456 -179.329 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -77.54 -56.34 4.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.882 0.372 . . . . 1.03 110.43 -179.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -86.02 140.17 30.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.812 -0.631 . . . . 0.59 110.751 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.3 mptt -119.22 -0.17 11.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.923 -0.581 . . . . 2.09 111.305 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -86.95 -45.07 11.14 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.087 0.47 . . . . 0.82 110.031 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 119.26 -6.66 12.9 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 110.586 -1.006 . . . . 0.87 110.586 -178.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -61.52 -33.52 73.96 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 114.642 -0.779 . . . . 0.74 109.966 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.66 41.97 97.49 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.008 -0.615 . . . . 1.3 112.77 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.408 HG21 ' HA ' ' A' ' 64' ' ' ASP . 1.0 OUTLIER -141.9 145.85 35.07 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.811 -0.194 . . . . 1.11 110.517 179.79 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.606 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 89.9 mt -84.68 106.47 14.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.076 0.465 . . . . 0.76 110.355 178.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.09 178.11 4.75 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.869 -0.605 . . . . 1.12 109.651 179.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.52 -35.22 67.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.01 0.433 . . . . 1.08 111.086 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -58.91 -49.08 79.15 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.943 -0.571 . . . . 0.77 112.168 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 54.8 mp0 -81.01 -26.01 36.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.257 0.551 . . . . 0.87 111.335 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.493 HD23 ' HE3' ' A' ' 51' ' ' MET . 20.1 tp -72.35 -32.85 66.83 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.387 -0.824 . . . . 1.12 110.213 -179.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -86.74 -33.37 13.06 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.87 -0.681 . . . . 0.36 113.825 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.88 -40.03 79.28 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 112.41 0.522 . . . . 0.54 112.41 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.5 p -70.51 -50.71 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 O-C-N 122.17 -0.331 . . . . 1.97 110.636 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.0 mtt -56.26 -43.74 79.04 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.065 0.46 . . . . 1.24 111.264 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -53.99 -42.01 68.56 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.373 -0.83 . . . . 2.37 111.872 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.8 m -84.17 -18.72 35.74 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.071 -0.513 . . . . 0.99 111.77 -178.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.6 mp -87.85 -53.16 4.9 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 111.894 0.331 . . . . 1.21 111.894 -178.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -150.55 43.19 0.73 Allowed Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.471 -0.871 . . . . 0.56 112.154 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 71.32 155.45 0.15 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.604 0.716 . . . . 3.6 111.344 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -95.61 134.19 24.57 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.728 -0.669 . . . . 0.96 109.91 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.25 -160.46 0.11 Allowed 'Trans proline' 0 C--O 1.23 0.116 0 C-N-CA 122.824 2.35 . . . . 0.72 111.301 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.1 p -83.63 165.17 19.21 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 109.689 -0.486 . . . . 1.09 109.689 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -64.91 -24.13 67.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 2.13 110.199 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.24 -50.87 62.29 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.313 -0.403 . . . . 0.8 110.859 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -68.11 -33.72 75.05 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.317 0.58 . . . . 0.81 110.199 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.5 tp -68.3 -41.36 81.04 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.732 -0.667 . . . . 0.94 111.424 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.525 ' O ' HG23 ' A' ' 52' ' ' ILE . 23.4 tt0 -67.64 -40.78 84.56 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.876 -0.602 . . . . 1.31 110.792 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -72.6 -27.07 61.94 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.576 -0.45 . . . . 1.42 110.706 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.493 ' HE3' HD23 ' A' ' 32' ' ' LEU . 1.1 tmm? -62.91 -38.58 91.53 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.494 -0.321 . . . . 0.78 110.48 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.525 HG23 ' O ' ' A' ' 49' ' ' GLN . 10.3 tp -78.76 -15.82 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 CA-C-O 121.368 0.604 . . . . 1.05 110.062 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -83.98 -27.88 28.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.827 0.822 . . . . 1.4 108.872 178.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.424 ' CD ' ' HG3' ' B' ' 287' ' ' ARG . 0.9 OUTLIER -81.54 14.79 2.36 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.977 -1.01 . . . . 1.58 111.0 -179.629 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.863 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 1.4 p -144.24 -41.16 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 116.477 -0.328 . . . . 1.37 111.253 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -77.94 92.19 4.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.653 0.739 . . . . 0.7 110.827 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.53 -29.29 68.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.082 -0.963 . . . . 1.17 112.283 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.96 -39.71 87.32 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 121.053 -0.259 . . . . 0.85 110.484 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 95.12 46.99 2.71 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.953 -0.642 . . . . 1.03 113.249 178.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -137.47 -0.76 2.15 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.432 0.634 . . . . 2.17 110.233 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.89 15.5 69.26 Favored Glycine 0 C--N 1.334 0.459 0 CA-C-N 115.57 -0.741 . . . . 0.73 113.191 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.8 m -134.05 133.82 41.63 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 121.377 0.608 . . . . 0.9 111.373 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.561 HD11 ' CH2' ' B' ' 292' ' ' TRP . 0.3 OUTLIER -121.19 118.6 56.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.966 -0.561 . . . . 0.95 109.763 178.974 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.408 ' HA ' HG21 ' A' ' 26' ' ' THR . 3.2 t70 -99.06 -172.59 2.31 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 123.743 0.652 . . . . 1.09 109.749 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.482 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 0.4 OUTLIER -51.75 -55.32 31.01 Favored Pre-proline 0 N--CA 1.469 0.494 0 CA-C-O 119.088 -0.482 . . . . 2.05 112.121 -179.659 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.482 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 6.0 Cg_endo -49.07 -44.61 32.31 Favored 'Trans proline' 0 C--N 1.354 0.816 0 C-N-CA 122.456 2.104 . . . . 0.85 112.48 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -69.34 -47.16 65.2 Favored 'General case' 0 C--O 1.222 -0.348 0 O-C-N 123.881 0.738 . . . . 0.66 110.51 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -59.03 -40.48 85.16 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.049 0.452 . . . . 0.91 111.462 -178.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 97.7 mt -57.23 -35.06 69.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.629 -0.714 . . . . 1.23 111.272 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -87.24 -37.82 16.9 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.279 -0.419 . . . . 1.14 110.903 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.509 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 11.1 tpt -59.1 -46.97 86.95 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.905 -0.589 . . . . 1.24 111.639 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.69 29.43 1.16 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.666 -0.243 . . . . 0.99 111.267 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -136.46 -49.63 0.66 Allowed 'General case' 0 C--O 1.237 0.415 0 CA-C-O 120.842 0.353 . . . . 1.21 110.357 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.064 -0.516 . . . . 2.96 109.842 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . 0.424 ' HG3' ' CD ' ' A' ' 54' ' ' GLU . 8.4 ttt-85 . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 109.353 -0.61 . . . . 3.73 109.353 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . 0.481 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -59.88 -23.77 63.72 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.049 0.452 . . . . 1.26 111.559 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . 0.689 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -67.43 -11.81 58.71 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-O 119.02 -0.514 . . . . 1.22 109.655 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -99.9 -35.32 9.79 Favored 'General case' 0 C--O 1.246 0.915 0 CA-C-O 121.473 0.654 . . . . 0.96 111.086 174.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . 0.497 ' O ' ' HG2' ' B' ' 295' ' ' PRO . 7.1 mp -79.73 -8.08 59.02 Favored 'General case' 0 C--O 1.213 -0.868 0 C-N-CA 123.878 0.871 . . . . 1.85 110.416 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.863 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 6.1 m0 -92.45 -55.1 0.25 Allowed Pre-proline 0 C--N 1.318 -0.792 0 N-CA-C 108.062 -1.088 . . . . 0.54 108.062 174.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.689 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 9.8 Cg_exo -48.51 -38.63 35.92 Favored 'Trans proline' 0 C--N 1.36 1.133 0 C-N-CA 123.337 2.691 . . . . 0.58 112.707 175.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.467 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 5.6 t -61.53 -62.58 5.62 Favored Pre-proline 0 CA--C 1.546 0.817 0 N-CA-C 108.616 -0.883 . . . . 1.39 108.616 178.108 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.497 ' HG2' ' O ' ' B' ' 291' ' ' LEU . 1.0 OUTLIER -46.25 -40.18 21.67 Favored 'Trans proline' 0 C--N 1.361 1.192 0 C-N-CA 123.156 2.571 . . . . 0.6 113.343 174.745 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 13.5 tp -68.86 -37.39 79.07 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.049 0.452 . . . . 1.08 109.968 178.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 27.2 ttt -63.61 -37.6 87.95 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.614 -0.884 . . . . 2.31 108.614 178.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 34.3 mm -62.75 -41.21 91.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.113 -0.949 . . . . 1.13 109.073 177.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . 0.463 ' CG ' ' HB2' ' A' ' 18' ' ' LEU . 0.2 OUTLIER -62.45 -43.75 98.06 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.452 -0.795 . . . . 1.11 109.753 179.182 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -64.06 -33.98 76.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.295 0.569 . . . . 2.87 110.419 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 39.5 m -69.98 -34.72 73.73 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.621 -0.718 . . . . 0.91 109.245 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -75.98 -28.61 57.93 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 109.423 -0.584 . . . . 2.89 109.423 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -69.97 -35.42 74.45 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.691 -0.855 . . . . 1.29 108.691 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -76.14 -40.02 53.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.189 -0.914 . . . . 1.36 109.104 178.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 6.9 m . . . . . 0 C--O 1.247 0.935 0 CA-C-N 114.848 -1.069 . . . . 1.39 111.763 178.692 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 . . . . . 0 C--O 1.235 0.318 0 CA-C-O 120.972 0.415 . . . . 1.18 110.518 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 18.6 m-30 -75.94 -40.31 54.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.698 -0.683 . . . . 1.8 109.3 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -64.79 -26.48 68.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.211 -0.904 . . . . 1.39 109.969 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.431 ' HG2' ' HE3' ' B' ' 299' ' ' LYS . 1.8 tp10 -67.37 -23.85 65.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.456 -0.793 . . . . 1.29 110.171 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.647 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -74.35 -37.54 63.49 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 109.793 -0.447 . . . . 0.85 109.793 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -75.26 -2.02 26.14 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.557 -0.457 . . . . 1.25 110.512 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -112.6 -53.56 2.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.965 0.412 . . . . 0.94 111.474 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.1 mt -85.76 -42.34 14.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.243 -0.435 . . . . 0.89 111.7 -179.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.647 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 82.6 t80 -75.06 -35.31 61.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.304 -0.407 . . . . 1.03 111.259 -177.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -91.96 130.58 37.68 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.844 -0.428 . . . . 0.59 109.844 179.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.416 ' HZ2' HG23 ' A' ' 35' ' ' VAL . 6.1 mptt -106.14 -9.65 16.84 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.439 0.533 . . . . 2.09 112.439 -178.145 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.67 -35.56 14.13 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 111.688 0.255 . . . . 0.82 111.688 -178.076 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.06 0.76 33.75 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 121.184 -0.531 . . . . 0.87 111.815 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -81.33 -27.98 34.73 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.812 0.339 . . . . 0.74 110.576 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.06 -46.07 3.59 Favored Glycine 0 CA--C 1.518 0.249 0 C-N-CA 121.318 -0.468 . . . . 1.3 113.475 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -53.27 123.72 12.65 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.522 0.564 . . . . 1.11 112.522 -179.045 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.647 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 18.0 mt -69.83 119.28 15.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-N 116.254 -0.43 . . . . 0.76 111.32 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.408 HG21 ' H ' ' A' ' 29' ' ' THR . 0.8 OUTLIER -127.26 168.66 14.44 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 108.9 -0.778 . . . . 1.12 108.9 178.485 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.408 ' H ' HG21 ' A' ' 28' ' ' THR . 0.1 OUTLIER -55.78 -33.78 64.68 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.817 0.341 . . . . 1.08 111.709 -179.894 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -60.47 -45.44 93.72 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.353 0.501 . . . . 0.77 112.353 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.4 mp0 -80.37 -23.21 40.62 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-O 121.216 0.531 . . . . 0.87 111.688 -178.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.406 HD13 ' CD1' ' B' ' 292' ' ' TRP . 16.0 tp -72.06 -50.74 25.86 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.851 -0.613 . . . . 1.12 110.167 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.09 -36.13 79.8 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.787 -0.642 . . . . 0.36 113.939 -179.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -55.7 -32.71 63.54 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 117.677 0.738 . . . . 0.54 112.385 -178.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.416 HG23 ' HZ2' ' A' ' 21' ' ' LYS . 99.0 t -77.53 -51.61 17.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.233 -0.587 . . . . 1.97 109.955 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 52.6 mtt -59.0 -32.81 70.02 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.924 -0.58 . . . . 1.24 111.841 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.1 ttt180 -58.43 -40.45 82.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.45 -0.341 . . . . 2.37 111.789 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.1 m -97.29 -6.65 33.92 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.112 0.482 . . . . 0.99 110.645 -178.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 16.2 tp -87.06 -47.74 8.67 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.911 -0.586 . . . . 1.21 110.167 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -161.48 47.47 0.37 Allowed Glycine 0 C--N 1.335 0.479 0 C-N-CA 120.45 -0.881 . . . . 0.56 112.634 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 69.98 140.23 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.508 0.671 . . . . 3.6 111.476 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -99.36 136.51 20.4 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.029 -0.532 . . . . 0.96 110.587 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.61 -163.74 0.22 Allowed 'Trans proline' 0 C--O 1.24 0.575 0 C-N-CA 122.898 2.398 . . . . 0.72 112.063 179.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 73.0 p -73.64 163.9 27.38 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.355 -0.609 . . . . 1.09 109.355 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -68.18 -29.13 67.92 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.914 0.387 . . . . 2.13 110.181 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.37 -49.76 72.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.946 -0.57 . . . . 0.8 110.422 178.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -63.54 -35.42 80.44 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.909 -0.587 . . . . 0.81 110.644 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.0 tp -70.07 -34.55 73.33 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.949 -0.569 . . . . 0.94 110.182 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.503 ' O ' HG22 ' A' ' 52' ' ' ILE . 15.8 tt0 -68.11 -39.91 82.67 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.545 -0.539 . . . . 1.31 109.545 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -61.02 -29.84 69.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.557 0.694 . . . . 1.42 109.722 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.0 mmm -65.43 -43.27 90.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.353 -0.84 . . . . 0.78 111.946 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.503 HG22 ' O ' ' A' ' 49' ' ' GLN . 4.8 tp -71.73 -18.33 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 CA-C-O 120.985 0.422 . . . . 1.05 111.355 -178.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -81.06 -25.02 37.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.625 0.726 . . . . 1.4 110.577 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.414 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 13.1 tt0 -93.51 8.26 41.35 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.325 -0.852 . . . . 1.58 111.046 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.752 ' HB ' ' CB ' ' B' ' 288' ' ' ALA . 8.5 p -142.85 25.86 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.806 0.812 . . . . 1.37 112.701 -177.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -146.65 95.53 2.61 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.683 0.754 . . . . 0.7 109.709 178.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.24 -29.98 70.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.334 -0.848 . . . . 1.17 112.047 -178.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.48 -16.02 62.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.998 0.428 . . . . 0.85 111.068 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.77 41.73 95.56 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 121.147 -0.549 . . . . 1.03 113.669 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -120.7 -19.96 7.21 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.955 0.407 . . . . 2.17 110.587 179.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.419 ' C ' ' HG1' ' A' ' 62' ' ' THR . . . 86.12 27.89 29.76 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 115.89 -0.595 . . . . 0.73 112.578 179.058 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.419 ' HG1' ' C ' ' A' ' 61' ' ' GLY . 16.3 m -154.78 142.88 20.24 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 121.365 0.602 . . . . 0.9 110.963 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.539 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 1.4 mt -123.35 113.71 38.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.696 -0.684 . . . . 0.95 109.787 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -87.06 -171.0 3.3 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.455 -0.793 . . . . 1.09 110.285 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.497 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 3.9 m-85 -58.48 -53.4 66.53 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 116.004 -0.544 . . . . 2.05 111.536 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.6 Cg_endo -55.17 -38.69 93.44 Favored 'Trans proline' 0 C--N 1.361 1.214 0 C-N-CA 122.274 1.982 . . . . 0.85 112.85 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.406 ' CD ' ' HA ' ' A' ' 63' ' ' ILE . 38.2 mt-10 -68.38 -44.94 74.05 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.222 0.534 . . . . 0.66 111.154 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -58.2 -29.77 65.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.235 -0.893 . . . . 0.91 112.135 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 80.4 mt -61.82 -27.3 68.67 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-N 116.41 -0.359 . . . . 1.23 111.427 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -106.62 -26.92 11.15 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.894 -0.322 . . . . 1.14 111.215 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.599 ' HG3' ' SD ' ' A' ' 72' ' ' MET . 10.5 tpt -49.82 -52.02 35.42 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.298 0.481 . . . . 1.24 112.298 -179.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.599 ' SD ' ' HG3' ' A' ' 71' ' ' MET . 0.3 OUTLIER -94.04 17.65 12.04 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.274 0.472 . . . . 0.99 112.274 -178.83 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -110.39 -41.57 4.34 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.885 0.374 . . . . 1.21 111.21 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? . . . . . 0 C--N 1.325 -0.481 0 N-CA-C 109.917 -0.401 . . . . 2.96 109.917 -179.539 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' B' ' 287' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 110.02 -0.363 . . . . 3.73 110.02 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . 0.752 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -58.58 -24.15 60.23 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-O 120.99 0.424 . . . . 1.26 110.517 178.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . 0.565 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -68.97 -14.54 63.1 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 115.733 -0.667 . . . . 1.22 111.002 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . 0.409 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 6.5 m120 -96.14 -39.88 9.48 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 109.092 -0.707 . . . . 0.96 109.092 175.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . 0.752 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 1.2 mp -64.53 -42.54 95.69 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 115.212 -0.903 . . . . 1.85 109.385 178.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.647 ' CZ2' HG21 ' A' ' 27' ' ' ILE . 4.4 m0 -56.56 -57.28 24.49 Favored Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 108.307 -0.998 . . . . 0.54 108.307 177.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.565 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 7.0 Cg_exo -50.06 -24.71 11.41 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.844 2.362 . . . . 0.58 113.759 175.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.506 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 50.6 m -60.44 -68.39 0.79 Allowed Pre-proline 0 CA--C 1.544 0.715 0 CA-C-O 118.484 -0.769 . . . . 1.39 109.585 178.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.752 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 69.6 Cg_exo -48.88 -38.32 38.09 Favored 'Trans proline' 0 C--N 1.371 1.72 0 C-N-CA 121.88 1.72 . . . . 0.6 112.629 175.094 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . 0.498 ' O ' ' HG3' ' B' ' 300' ' ' ARG . 19.6 tp -61.39 -37.93 85.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.161 -0.472 . . . . 1.08 110.011 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 6.2 ttt -67.16 -39.69 86.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.818 -0.628 . . . . 2.31 109.46 178.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 43.6 mm -64.73 -39.63 86.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.646 0.736 . . . . 1.13 109.057 178.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . 0.515 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.1 OUTLIER -62.68 -40.84 98.36 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.905 -1.043 . . . . 1.11 109.119 178.011 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . 0.498 ' HG3' ' O ' ' B' ' 296' ' ' LEU . 30.3 mtp180 -63.29 -44.79 94.05 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.734 -0.666 . . . . 2.87 109.898 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 50.7 m -59.95 -37.83 80.69 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.71 -0.677 . . . . 0.91 110.109 178.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.2 tptp -73.25 -38.31 66.03 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 110.09 -0.337 . . . . 2.89 110.09 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -64.83 -28.48 69.58 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.603 0.716 . . . . 1.29 109.638 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -81.46 -30.99 33.2 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.142 -0.935 . . . . 1.36 109.636 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 13.0 m . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.304 -0.855 . . . . 1.39 112.294 179.112 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.233 0.209 0 CA-C-O 121.04 0.448 . . . . 1.18 110.475 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -76.51 -32.08 58.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.98 -0.555 . . . . 1.8 110.032 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -72.09 -15.45 62.01 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.171 0.51 . . . . 1.39 110.679 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -72.45 -26.05 61.68 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.907 -0.588 . . . . 1.29 110.386 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.565 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -66.73 -43.09 85.12 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.163 -0.471 . . . . 0.85 110.78 -178.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -80.65 5.32 15.89 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.367 -0.379 . . . . 1.25 110.871 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.3 m -112.74 -41.28 3.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.94 112.075 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.499 ' HB2' ' HG3' ' B' ' 299' ' ' LYS . 18.2 mt -103.49 -44.15 5.2 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.438 0.532 . . . . 0.89 112.438 -178.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.565 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 83.1 t80 -62.59 -34.23 76.58 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.247 0.546 . . . . 1.03 110.435 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -93.95 138.63 31.86 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.688 -0.687 . . . . 0.59 110.139 178.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -124.52 32.62 5.43 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.257 -0.277 . . . . 2.09 110.989 -179.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -131.61 -31.14 1.59 Allowed 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.641 -0.424 . . . . 0.82 111.195 -179.207 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.73 18.65 17.6 Favored Glycine 0 CA--C 1.505 -0.562 0 N-CA-C 111.045 -0.822 . . . . 0.87 111.045 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -97.36 -32.17 12.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.294 -0.453 . . . . 0.74 110.596 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 69.13 31.6 72.2 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 120.922 -0.656 . . . . 1.3 113.707 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.82 138.07 53.29 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 117.909 0.854 . . . . 1.11 110.675 179.17 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.6 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 28.6 mt -81.8 111.46 18.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-O 121.089 0.471 . . . . 0.76 111.219 -178.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -128.11 170.18 13.23 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.353 -0.84 . . . . 1.12 109.319 178.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.84 -31.74 59.8 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.18 0.514 . . . . 1.08 112.217 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.2 tttt -62.11 -45.53 93.06 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.273 0.559 . . . . 0.77 112.212 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.5 mp0 -79.22 -20.95 47.0 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.896 -0.593 . . . . 0.87 111.162 -178.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 23.5 tp -80.0 -47.39 15.01 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.428 -0.806 . . . . 1.12 110.602 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.14 -37.12 72.34 Favored Glycine 0 CA--C 1.512 -0.145 0 CA-C-N 115.429 -0.805 . . . . 0.36 113.289 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 p -57.12 -28.1 62.39 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.983 0.392 . . . . 0.54 111.89 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 93.5 t -77.07 -56.28 8.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 120.881 -0.328 . . . . 1.97 110.616 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 51.3 mtt -57.69 -37.72 73.95 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.447 -0.342 . . . . 1.24 110.872 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -55.12 -42.18 72.64 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.755 -0.657 . . . . 2.37 111.366 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.8 m -89.58 -19.48 24.92 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.842 0.354 . . . . 0.99 111.786 -178.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.3 tp -79.9 -36.87 35.82 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 112.14 0.422 . . . . 1.21 112.14 -179.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.13 43.81 0.14 Allowed Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.702 -0.761 . . . . 0.56 112.454 -178.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 70.85 147.49 0.07 Allowed 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.77 0.795 . . . . 3.6 111.936 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -102.64 134.8 19.69 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.644 -0.707 . . . . 0.96 109.819 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.7 -161.2 0.11 Allowed 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.475 2.117 . . . . 0.72 112.514 179.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.5 p -76.43 162.16 28.08 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.535 -0.302 . . . . 1.09 110.319 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -61.92 -31.03 71.31 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 116.676 -0.238 . . . . 2.13 111.199 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.72 -49.21 77.37 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.144 0.497 . . . . 0.8 110.312 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -66.52 -35.12 79.47 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.054 -0.521 . . . . 0.81 110.877 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 21.2 tp -71.61 -34.54 69.94 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.642 -0.708 . . . . 0.94 111.217 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -71.55 -39.28 70.78 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.697 -0.483 . . . . 1.31 109.697 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -60.04 -32.38 70.85 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.562 -0.745 . . . . 1.42 109.909 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.404 ' SD ' ' HA ' ' B' ' 288' ' ' ALA . 1.8 mmm -62.22 -45.98 90.94 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.196 -0.911 . . . . 0.78 110.66 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.1 tp -75.98 -18.49 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 C-N-CA 120.71 -0.396 . . . . 1.05 111.41 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -78.96 -20.09 50.05 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.298 0.571 . . . . 1.4 110.269 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.49 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 14.4 tt0 -99.08 9.5 43.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.564 -0.744 . . . . 1.58 111.706 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.755 ' HB ' ' CB ' ' B' ' 288' ' ' ALA . 9.5 p -137.6 -13.07 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-O 121.227 0.537 . . . . 1.37 112.34 -176.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -109.49 98.48 7.86 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.74 -0.837 . . . . 0.7 108.74 178.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.0 -22.18 61.46 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 115.957 -0.565 . . . . 1.17 111.936 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.42 -24.28 57.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.155 0.502 . . . . 0.85 110.529 178.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 75.8 29.04 59.87 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.926 -0.654 . . . . 1.03 113.219 178.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -108.05 -22.17 12.51 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.137 -0.69 . . . . 2.17 109.137 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.99 -2.71 64.14 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.846 -0.693 . . . . 0.73 113.526 178.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.3 m -128.13 153.51 46.78 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-O 121.289 0.566 . . . . 0.9 111.526 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.608 HD11 ' CH2' ' B' ' 292' ' ' TRP . 0.5 OUTLIER -132.57 122.76 48.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.628 -0.715 . . . . 0.95 110.317 179.515 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -96.11 -171.17 2.26 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 123.709 0.631 . . . . 1.09 110.503 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.51 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 4.8 m-85 -54.18 -55.09 40.39 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 123.801 0.84 . . . . 2.05 111.422 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 10.1 Cg_endo -53.33 -42.68 63.45 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 122.937 2.425 . . . . 0.85 111.845 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.423 ' CD ' ' HA ' ' A' ' 63' ' ' ILE . 23.5 mt-10 -65.47 -48.94 70.95 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.216 -0.902 . . . . 0.66 109.68 178.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -56.67 -43.93 80.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.316 0.579 . . . . 0.91 110.367 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.4 mt -55.56 -31.86 62.52 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.177 -0.92 . . . . 1.23 111.72 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.3 m -94.61 -38.28 10.93 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.921 0.391 . . . . 1.14 111.263 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.482 ' HE3' ' HA ' ' B' ' 289' ' ' ALA . 12.4 tpt -61.26 -59.24 5.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.992 -0.549 . . . . 1.24 111.937 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -77.93 31.98 0.17 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.4 -0.364 . . . . 0.99 111.437 -179.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.45 ' H ' ' C ' ' A' ' 71' ' ' MET . . . -136.69 -22.32 1.25 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.171 -0.468 . . . . 1.21 111.604 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? . . . . . 0 C--N 1.328 -0.368 0 CA-C-O 121.255 0.55 . . . . 2.96 111.437 -179.18 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . 0.49 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 120.906 0.384 . . . . 3.73 110.146 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . 0.755 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -57.86 -25.01 60.14 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 116.12 -0.491 . . . . 1.26 112.3 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . 0.482 ' HA ' ' HE3' ' A' ' 71' ' ' MET . . . -69.94 -1.72 10.42 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 113.24 0.83 . . . . 1.22 113.24 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . 0.467 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 7.3 m120 -112.11 -30.77 7.11 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.303 0.573 . . . . 0.96 109.477 176.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 33.0 mt -80.92 -6.02 58.17 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 114.879 -1.055 . . . . 1.85 109.809 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.608 ' CH2' HD11 ' A' ' 63' ' ' ILE . 1.7 m0 -92.13 -53.23 0.27 Allowed Pre-proline 0 CA--C 1.543 0.7 0 N-CA-C 107.589 -1.263 . . . . 0.54 107.589 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.467 ' HD2' ' C ' ' B' ' 290' ' ' ASN . 13.3 Cg_exo -51.68 -36.3 60.84 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 123.05 2.5 . . . . 0.58 112.921 175.193 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.471 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 2.7 t -58.98 -61.45 7.79 Favored Pre-proline 0 CA--C 1.548 0.885 0 CA-C-O 119.282 -0.389 . . . . 1.39 111.063 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.496 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 88.4 Cg_exo -53.12 -33.09 62.23 Favored 'Trans proline' 0 C--N 1.358 1.058 0 C-N-CA 122.691 2.261 . . . . 0.6 112.596 178.191 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 15.5 tp -68.02 -35.37 78.18 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.126 0.489 . . . . 1.08 110.091 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 16.7 ttt -70.34 -38.43 74.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.23 -0.896 . . . . 2.31 108.699 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . 0.4 HG12 ' O ' ' B' ' 294' ' ' SER . 48.9 mm -61.74 -38.37 80.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 108.211 -1.033 . . . . 1.13 108.211 177.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . 0.499 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.4 OUTLIER -59.99 -39.97 87.56 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.308 -0.627 . . . . 1.11 109.308 177.451 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -64.89 -41.15 95.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.55 -0.75 . . . . 2.87 110.414 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 19.4 m -63.45 -35.88 81.91 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.738 -0.664 . . . . 0.91 109.595 178.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 14.3 tptp -76.28 -30.21 57.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.066 -0.515 . . . . 2.89 109.736 179.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 9.4 tttp -68.71 -34.58 75.88 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.806 -0.812 . . . . 1.29 108.806 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -76.01 -40.34 53.78 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.568 -1.196 . . . . 1.36 110.08 179.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.668 -0.682 . . . . 1.39 111.455 179.575 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 . . . . . 0 C--O 1.236 0.343 0 CA-C-O 120.866 0.365 . . . . 1.18 111.32 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -80.46 -37.54 31.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.145 0.498 . . . . 1.8 109.802 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -61.64 -22.69 65.49 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.507 0.67 . . . . 1.39 111.206 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.522 ' CG ' ' HE3' ' B' ' 299' ' ' LYS . 1.3 tp10 -70.88 -22.0 62.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.387 -0.824 . . . . 1.29 112.076 -177.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.687 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -70.18 -36.31 74.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.181 0.515 . . . . 0.85 110.647 179.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.403 ' HB3' ' HA3' ' A' ' 25' ' ' GLY . 10.5 m-85 -86.19 16.55 4.25 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.022 -0.535 . . . . 1.25 109.665 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.6 m -125.56 -56.58 1.49 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.886 -0.597 . . . . 0.94 112.202 -178.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.478 ' HB2' ' CG ' ' B' ' 299' ' ' LYS . 13.6 mt -96.1 -30.56 13.47 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.255 0.465 . . . . 0.89 112.255 -178.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.687 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 46.5 t80 -73.92 -34.03 64.2 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.062 0.458 . . . . 1.03 110.096 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -91.22 140.69 29.56 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.685 -0.689 . . . . 0.59 109.605 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -114.74 6.55 15.63 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.579 0.585 . . . . 2.09 112.579 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.62 -53.86 2.62 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.419 -0.512 . . . . 0.82 110.942 -178.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 139.44 4.38 1.46 Allowed Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.827 -0.701 . . . . 0.87 112.34 -178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.93 -58.15 2.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.974 0.416 . . . . 0.74 110.017 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.403 ' HA3' ' HB3' ' A' ' 16' ' ' PHE . . . 111.84 -29.95 8.13 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.798 -0.637 . . . . 1.3 111.556 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.85 130.22 40.28 Favored 'General case' 0 C--N 1.323 -0.549 0 O-C-N 123.925 0.427 . . . . 1.11 111.859 -179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.678 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 24.1 mt -78.79 108.45 12.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 116.107 -0.497 . . . . 0.76 110.615 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.91 170.9 9.34 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 108.49 -0.93 . . . . 1.12 108.49 177.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -31.69 66.42 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 111.679 0.252 . . . . 1.08 111.679 -179.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.9 tttt -63.8 -44.96 91.76 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.066 0.395 . . . . 0.77 112.066 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 25.2 mp0 -79.97 -21.81 43.31 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 111.742 0.275 . . . . 0.87 111.742 -178.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.5 HD22 ' HE3' ' A' ' 51' ' ' MET . 18.1 tp -79.53 -46.62 17.01 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.083 -0.508 . . . . 1.12 110.77 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.82 -36.32 86.74 Favored Glycine 0 N--CA 1.453 -0.212 0 CA-C-N 115.851 -0.613 . . . . 0.36 113.104 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.71 -31.05 67.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.771 0.286 . . . . 0.54 111.351 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 67.0 t -73.23 -56.55 9.18 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 N-CA-C 109.265 -0.643 . . . . 1.97 109.265 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 59.9 mtt -52.15 -46.9 65.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.121 -0.945 . . . . 1.24 111.134 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -57.28 -38.02 73.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.433 -0.803 . . . . 2.37 111.3 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.0 m -95.41 14.18 23.42 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.102 -0.499 . . . . 0.99 111.671 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.8 tp -122.03 -43.1 2.35 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.536 0.208 . . . . 1.21 110.916 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -164.24 49.93 0.29 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.618 -0.801 . . . . 0.56 112.599 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 72.35 146.07 0.08 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.517 0.727 . . . . 3.6 111.707 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -87.2 140.55 32.44 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.453 -0.794 . . . . 0.96 109.88 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -77.91 -172.96 1.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.271 1.981 . . . . 0.72 111.388 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.7 p -81.76 160.33 23.63 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.935 -0.765 . . . . 1.09 108.935 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -55.16 -32.92 62.52 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.059 0.392 . . . . 2.13 112.059 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.41 -52.34 58.68 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.224 -0.444 . . . . 0.8 110.829 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -64.01 -34.03 77.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.439 . . . . 0.81 110.839 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 15.3 tp -63.73 -47.15 82.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.256 -0.429 . . . . 0.94 110.346 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -69.97 -33.39 72.02 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 116.353 -0.385 . . . . 1.31 111.459 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -71.78 -26.8 62.58 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.318 0.58 . . . . 1.42 110.157 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.5 ' HE3' HD22 ' A' ' 32' ' ' LEU . 1.8 mmm -61.95 -42.25 98.9 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.462 -0.79 . . . . 0.78 110.859 178.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.4 tp -76.87 -14.67 14.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-O 121.164 0.507 . . . . 1.05 110.278 -179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.5 t30 -78.37 -22.15 48.35 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.686 0.755 . . . . 1.4 109.054 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.617 ' OE2' ' HA ' ' B' ' 287' ' ' ARG . 2.4 tt0 -98.25 22.52 9.47 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.417 -0.811 . . . . 1.58 111.047 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.752 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 9.1 p -154.07 -36.65 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.205 0 N-CA-C 113.627 0.973 . . . . 1.37 113.627 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -89.77 91.18 8.53 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.243 -0.583 . . . . 0.7 109.524 179.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.36 -24.91 67.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.197 -0.91 . . . . 1.17 113.364 -178.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -75.58 -10.95 59.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.93 0.395 . . . . 0.85 110.66 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.08 48.59 68.98 Favored Glycine 0 CA--C 1.519 0.312 0 CA-C-N 116.077 -0.51 . . . . 1.03 114.128 178.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -128.87 -27.79 2.5 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.198 0.523 . . . . 2.17 110.027 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.73 17.88 36.97 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.78 -0.645 . . . . 0.73 113.2 178.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 2.0 m -141.75 139.99 32.98 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.886 0.343 . . . . 0.9 110.808 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.537 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.9 OUTLIER -124.56 118.92 54.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.119 0.485 . . . . 0.95 111.202 179.879 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -93.01 -167.14 1.67 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.368 -0.833 . . . . 1.09 110.472 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.47 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 28.3 m-85 -57.97 -53.32 67.0 Favored Pre-proline 0 CA--C 1.54 0.592 0 C-N-CA 122.936 0.494 . . . . 2.05 112.292 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.47 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.3 Cg_endo -57.53 -36.44 98.66 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.991 1.794 . . . . 0.85 112.026 179.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -72.14 -39.48 68.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.526 -0.761 . . . . 0.66 110.943 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -66.12 -37.47 85.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.245 -0.434 . . . . 0.91 109.835 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.438 ' O ' ' HB1' ' A' ' 73' ' ' ALA . 35.8 mt -63.71 -32.64 74.2 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.817 -0.629 . . . . 1.23 110.286 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.5 m -92.31 11.07 27.13 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.95 -0.568 . . . . 1.14 110.644 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.482 ' HE2' ' HA ' ' B' ' 289' ' ' ALA . 11.7 tpt -119.15 -68.25 0.93 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.369 -0.378 . . . . 1.24 111.181 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.523 ' HE1' ' HB3' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -69.86 -17.68 63.39 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.735 0.303 . . . . 0.99 111.727 -178.454 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.438 ' HB1' ' O ' ' A' ' 69' ' ' LEU . . . -104.06 9.47 36.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.918 0.39 . . . . 1.21 110.459 179.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.235 0.319 0 CA-C-N 116.27 -0.423 . . . . 2.96 111.833 -178.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . 0.617 ' HA ' ' OE2' ' A' ' 54' ' ' GLU . 1.7 tpm_? . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 109.441 -0.578 . . . . 3.73 109.441 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . 0.727 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -61.4 -28.16 69.05 Favored 'General case' 0 C--O 1.214 -0.815 0 N-CA-C 113.295 0.85 . . . . 1.26 113.295 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . 0.536 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -70.59 1.3 5.36 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.03 0.752 . . . . 1.22 113.03 -179.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -115.95 -37.28 3.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 122.847 1.308 . . . . 0.96 109.431 176.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 25.6 mt -80.52 -7.14 59.09 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 113.245 -1.798 . . . . 1.85 110.662 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.752 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 5.0 m0 -93.81 -53.88 0.24 Allowed Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 107.355 -1.35 . . . . 0.54 107.355 174.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.536 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 21.5 Cg_exo -50.94 -37.11 55.58 Favored 'Trans proline' 0 C--N 1.367 1.508 0 C-N-CA 122.578 2.185 . . . . 0.58 113.029 175.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 294' ' ' SER . . . . . . . . . . . . . 1.4 t -59.67 -60.82 9.34 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-O 119.34 -0.362 . . . . 1.39 110.346 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.418 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 85.2 Cg_exo -51.14 -38.4 60.36 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 122.203 1.935 . . . . 0.6 112.091 176.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 9.5 tp -64.65 -36.73 85.21 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.824 0.345 . . . . 1.08 110.345 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 17.5 ttt -66.43 -41.66 88.87 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.499 0.666 . . . . 2.31 109.285 177.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 20.4 mm -62.93 -35.6 72.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 108.447 -0.946 . . . . 1.13 108.447 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . 0.522 ' HE3' ' CG ' ' A' ' 14' ' ' GLU . 0.2 OUTLIER -66.35 -40.86 90.08 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.88 -1.054 . . . . 1.11 109.381 178.08 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 73.1 mtt180 -63.34 -40.01 96.11 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.198 -0.455 . . . . 2.87 110.101 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 66.2 m -64.71 -42.78 95.01 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.842 -0.617 . . . . 0.91 109.782 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -69.06 -36.9 78.18 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.119 -0.491 . . . . 2.89 110.561 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 3.3 tttp -63.81 -33.08 74.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.815 0.817 . . . . 1.29 109.197 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -81.61 -21.76 38.1 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.699 -1.137 . . . . 1.36 110.81 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.251 1.161 0 CA-C-O 118.575 -0.726 . . . . 1.39 110.265 179.083 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 . . . . . 0 N--CA 1.464 0.237 0 CA-C-O 120.984 0.421 . . . . 1.18 111.265 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -82.45 -38.4 24.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 1.8 110.445 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.411 ' HA ' ' CE2' ' A' ' 16' ' ' PHE . 38.2 mtmt -69.62 -13.9 62.55 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.372 0.606 . . . . 1.39 110.335 179.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -73.19 -17.06 61.4 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.277 -0.874 . . . . 1.29 110.696 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.624 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -69.9 -32.82 71.34 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.341 0.591 . . . . 0.85 110.377 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.411 ' CE2' ' HA ' ' A' ' 13' ' ' LYS . 12.6 m-85 -79.92 5.33 14.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.856 -0.611 . . . . 1.25 111.505 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -124.94 -47.56 1.79 Allowed 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 121.049 -0.261 . . . . 0.94 110.99 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.404 ' HB2' ' CG ' ' B' ' 299' ' ' LYS . 35.8 mt -93.22 -38.96 11.27 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 111.866 0.321 . . . . 0.89 111.866 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.624 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 92.0 t80 -74.4 -42.15 59.73 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.861 0.362 . . . . 1.03 110.898 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -87.31 136.56 32.89 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.286 -0.416 . . . . 0.59 110.671 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -106.35 -11.63 15.92 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.145 0.424 . . . . 2.09 112.145 -178.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.87 -40.76 11.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.155 0.502 . . . . 0.82 110.655 -179.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.07 16.72 15.82 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 110.922 -0.871 . . . . 0.87 110.922 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -96.86 -21.42 17.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.892 0.377 . . . . 0.74 111.02 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.8 -46.11 3.41 Favored Glycine 0 C--O 1.227 -0.291 0 C-N-CA 121.085 -0.579 . . . . 1.3 114.269 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.39 129.84 29.64 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 117.046 0.423 . . . . 1.11 111.622 -179.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.611 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 54.4 mt -83.73 115.79 26.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-O 121.362 0.601 . . . . 0.76 111.838 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -126.49 171.86 10.7 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 114.884 -1.053 . . . . 1.12 109.861 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.437 HG21 ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -57.09 -27.68 61.97 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.742 0.645 . . . . 1.08 112.742 179.405 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -68.1 -39.09 82.91 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.173 0.435 . . . . 0.77 112.173 -178.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 -84.92 -19.22 32.56 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 121.957 -0.464 . . . . 0.87 110.96 -178.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 20.4 tp -79.13 -41.2 29.1 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.894 -0.594 . . . . 1.12 110.237 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.33 -28.46 55.68 Favored Glycine 0 C--O 1.226 -0.372 0 C-N-CA 120.946 -0.645 . . . . 0.36 113.843 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.83 -25.66 68.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 117.419 0.61 . . . . 0.54 111.288 -179.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.2 t -80.31 -55.69 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 N-CA-C 109.573 -0.528 . . . . 1.97 109.573 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 33.7 mtt -54.47 -39.62 67.65 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.149 0.499 . . . . 1.24 111.035 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -62.4 -38.44 89.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.576 -0.738 . . . . 2.37 111.867 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.2 m -93.12 2.45 56.71 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.078 0.466 . . . . 0.99 111.796 -177.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.0 tp -109.35 -57.91 2.1 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.835 -0.621 . . . . 1.21 110.773 -179.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -145.8 44.61 0.85 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 119.988 -1.101 . . . . 0.56 113.323 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 73.08 140.62 0.06 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.68 0.752 . . . . 3.6 111.834 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -81.68 138.05 47.43 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.384 -0.825 . . . . 0.96 110.496 -179.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.72 -165.55 0.3 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.804 2.336 . . . . 0.72 112.862 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 68.6 p -79.3 161.82 26.02 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.949 -0.389 . . . . 1.09 109.949 178.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -59.27 -36.95 76.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.788 0.327 . . . . 2.13 110.483 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.3 -47.13 80.66 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.408 -0.36 . . . . 0.8 110.175 179.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -63.25 -40.95 98.85 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.119 0.485 . . . . 0.81 110.282 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.437 ' HG ' HG21 ' A' ' 29' ' ' THR . 55.3 tp -59.03 -43.6 91.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.444 -0.798 . . . . 0.94 111.072 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.539 ' O ' HG22 ' A' ' 52' ' ' ILE . 19.1 tt0 -75.74 -35.06 60.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.044 -0.525 . . . . 1.31 111.665 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -68.04 -25.42 65.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.925 0.393 . . . . 1.42 110.844 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.9 mmm -64.37 -44.96 89.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.364 -0.38 . . . . 0.78 110.068 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.539 HG22 ' O ' ' A' ' 49' ' ' GLN . 6.9 tp -70.92 -21.35 22.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.077 0.465 . . . . 1.05 109.976 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -78.21 -17.73 56.36 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.994 -0.743 . . . . 1.4 108.994 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.486 ' HG3' ' H ' ' B' ' 288' ' ' ALA . 19.3 tp10 -95.81 -0.67 50.91 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.418 -0.81 . . . . 1.58 111.239 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.767 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 1.0 OUTLIER -122.22 -46.27 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 N-CA-C 112.177 0.436 . . . . 1.37 112.177 -179.756 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -76.52 99.75 5.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.41 0.624 . . . . 0.7 111.288 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.71 -22.62 46.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.182 -0.917 . . . . 1.17 111.425 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -76.56 -0.78 24.44 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.194 -0.457 . . . . 0.85 111.967 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.97 46.37 84.45 Favored Glycine 0 C--O 1.224 -0.487 0 C-N-CA 121.554 -0.355 . . . . 1.03 113.977 178.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -127.46 -17.66 4.6 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.419 0.628 . . . . 2.17 109.697 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 76.64 24.08 68.43 Favored Glycine 0 N--CA 1.452 -0.238 0 CA-C-N 115.537 -0.756 . . . . 0.73 112.921 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.0 m -151.75 146.71 25.94 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.938 0.399 . . . . 0.9 110.552 179.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.455 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 0.9 OUTLIER -123.93 109.07 22.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.283 0.564 . . . . 0.95 110.023 179.12 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -78.81 -176.65 5.07 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.296 -0.866 . . . . 1.09 110.062 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.487 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 74.8 m-85 -57.72 -53.63 63.66 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 116.262 -0.426 . . . . 2.05 111.309 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 10.5 Cg_endo -56.23 -35.72 95.87 Favored 'Trans proline' 0 C--N 1.357 0.976 0 C-N-CA 122.497 2.131 . . . . 0.85 112.138 178.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -69.45 -39.21 77.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.164 -0.471 . . . . 0.66 110.047 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -59.66 -39.22 83.71 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.57 -0.741 . . . . 0.91 111.239 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 94.4 mt -64.29 -36.6 84.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.249 0.547 . . . . 1.23 110.599 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.6 m -80.41 -39.6 28.03 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.702 -0.681 . . . . 1.14 111.333 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.468 ' HE3' ' HA ' ' B' ' 289' ' ' ALA . 7.3 tpt -62.69 -54.45 39.21 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.85 -0.614 . . . . 1.24 112.056 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.407 ' HE1' ' HB3' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -72.17 -4.61 30.24 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.708 0.632 . . . . 0.99 112.708 -177.647 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -101.48 2.9 39.74 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.995 0.426 . . . . 1.21 110.287 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' A' ' 74' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.327 -0.384 0 CA-C-N 116.038 -0.528 . . . . 2.96 111.051 -179.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . 0.414 ' HB3' ' OD1' ' B' ' 290' ' ' ASN . 4.4 ttm180 . . . . . 0 N--CA 1.477 0.91 0 N-CA-C 109.858 -0.423 . . . . 3.73 109.858 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . 0.548 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -67.26 -20.44 65.66 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 112.568 0.581 . . . . 1.26 112.568 -178.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . 0.562 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -72.06 -3.49 23.31 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-O 121.356 0.598 . . . . 1.22 112.111 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . 0.414 ' OD1' ' HB3' ' B' ' 287' ' ' ARG . 3.2 m120 -111.86 -33.76 6.21 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 122.578 1.18 . . . . 0.96 109.893 175.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . 0.415 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 8.1 mp -79.74 -13.11 59.68 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 114.267 -1.333 . . . . 1.85 110.283 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.767 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 3.4 m0 -86.88 -54.65 0.38 Allowed Pre-proline 0 CA--C 1.531 0.222 0 N-CA-C 107.385 -1.339 . . . . 0.54 107.385 175.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.562 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 18.3 Cg_exo -49.23 -33.21 27.45 Favored 'Trans proline' 0 C--N 1.366 1.465 0 C-N-CA 122.631 2.221 . . . . 0.58 112.812 174.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.561 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 13.7 t -58.22 -63.43 3.96 Favored Pre-proline 0 CA--C 1.547 0.837 0 CA-C-O 118.999 -0.524 . . . . 1.39 110.847 179.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.561 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 76.1 Cg_exo -52.22 -35.82 64.86 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 122.243 1.962 . . . . 0.6 112.236 176.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 18.7 tp -69.09 -31.42 70.13 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.054 0.454 . . . . 1.08 109.782 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 15.5 ttt -71.73 -42.55 67.15 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.175 -1.046 . . . . 2.31 108.175 178.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 42.0 mm -62.74 -33.14 58.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 107.94 -1.133 . . . . 1.13 107.94 176.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . 0.445 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.1 OUTLIER -64.31 -36.92 85.69 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 108.66 -0.867 . . . . 1.11 108.66 177.664 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -66.7 -36.24 82.02 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.742 -0.836 . . . . 2.87 108.742 178.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 12.8 m -66.9 -38.33 86.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.973 -1.012 . . . . 0.91 109.275 178.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.45 -35.41 65.75 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.105 -0.702 . . . . 2.89 109.105 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -66.72 -36.06 81.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.399 0.619 . . . . 1.29 109.439 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -72.17 -39.92 68.32 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.197 -0.91 . . . . 1.36 109.145 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 8.4 m . . . . . 0 C--O 1.252 1.2 0 CA-C-O 118.239 -0.886 . . . . 1.39 110.149 179.356 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.214 0 CA-C-O 120.86 0.362 . . . . 2.97 110.387 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -90.14 50.36 1.85 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.156 -0.475 . . . . 3.47 110.29 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.5 -51.86 56.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.213 -0.448 . . . . 3.53 110.515 -179.054 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.7 mt -89.93 77.67 6.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.011 0.434 . . . . 2.32 109.93 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -80.14 -85.09 0.09 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.824 -0.625 . . . . 1.92 111.022 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 54.39 56.29 7.07 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.665 0.745 . . . . 1.44 109.965 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -116.2 -52.43 2.59 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.219 -0.9 . . . . 1.4 110.128 -178.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -97.7 -34.77 10.79 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.252 -0.885 . . . . 1.75 109.394 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.449 ' HA ' ' CD2' ' A' ' 12' ' ' PHE . 3.1 mt -57.26 -26.95 26.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 114.983 -1.008 . . . . 1.55 111.721 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.98 -25.83 68.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.166 0.508 . . . . 1.26 110.895 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -85.02 -21.26 29.51 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.983 -0.553 . . . . 1.18 111.551 -179.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.449 ' CD2' ' HA ' ' A' ' 9' ' ' ILE . 20.3 m-85 -74.49 -40.93 61.53 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.08 -0.711 . . . . 1.8 109.08 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -68.43 -22.36 64.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.455 -0.793 . . . . 1.39 110.331 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.414 ' CG ' ' HE3' ' B' ' 299' ' ' LYS . 5.1 tp10 -69.62 -27.12 64.81 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.653 -0.703 . . . . 1.29 110.478 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.32 -47.6 85.19 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.673 -0.491 . . . . 0.85 109.673 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -73.89 3.46 6.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.069 0.462 . . . . 1.25 111.61 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.4 m -112.76 -35.0 5.62 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.258 -0.428 . . . . 0.94 111.886 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.4 mt -105.13 -26.44 12.09 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.144 0.424 . . . . 0.89 112.144 -178.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -83.0 -49.06 9.97 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 121.043 -0.263 . . . . 1.03 111.318 -178.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.64 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 32.5 t70 -92.24 140.02 30.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.955 0.407 . . . . 0.59 111.166 -179.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -125.43 3.44 7.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.0 -0.545 . . . . 2.09 110.5 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.618 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 4.2 m-20 -90.17 -28.6 18.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.161 0.505 . . . . 0.82 109.976 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.89 27.7 9.34 Favored Glycine 0 N--CA 1.444 -0.784 0 N-CA-C 111.118 -0.793 . . . . 0.87 111.118 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -100.48 -31.54 11.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.305 -0.448 . . . . 0.74 111.126 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 69.45 36.99 78.58 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.867 -0.683 . . . . 1.3 112.085 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.3 p -139.4 152.96 47.52 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.823 -0.436 . . . . 1.11 109.823 179.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.613 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 74.5 mt -101.86 111.52 31.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-O 120.975 0.417 . . . . 0.76 110.936 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.7 p -118.71 -178.93 3.66 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.913 -0.773 . . . . 1.12 108.913 178.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.27 -30.45 60.13 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.288 -0.414 . . . . 1.08 111.739 178.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -64.71 -46.43 82.35 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.949 -0.568 . . . . 0.77 112.313 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.647 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 50.4 mp0 -81.88 -25.87 34.66 Favored 'General case' 0 C--N 1.332 -0.165 0 O-C-N 121.903 -0.498 . . . . 0.87 111.095 -177.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.424 HD13 ' CD1' ' B' ' 292' ' ' TRP . 37.5 tp -71.51 -33.55 69.32 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.531 -0.758 . . . . 1.12 110.755 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -91.41 -29.22 12.62 Favored Glycine 0 C--O 1.229 -0.187 0 C-N-CA 120.651 -0.785 . . . . 0.36 113.908 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -60.67 -40.73 93.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 117.354 0.577 . . . . 0.54 112.483 -178.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.3 p -67.5 -48.21 77.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 121.047 -0.261 . . . . 1.97 110.661 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 43.6 mtt -61.24 -36.63 80.49 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.784 0.326 . . . . 1.24 110.432 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 -56.58 -33.29 66.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.243 -0.89 . . . . 2.37 111.639 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 m -112.38 24.79 12.15 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.178 0.513 . . . . 0.99 111.019 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 22.7 tp -125.6 -49.02 1.65 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.031 -0.531 . . . . 1.21 111.124 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -155.5 43.7 0.55 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 121.015 -0.612 . . . . 0.56 112.214 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 71.67 143.32 0.06 Allowed 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.368 0.667 . . . . 3.6 111.165 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -88.05 133.0 38.12 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.703 -0.68 . . . . 0.96 110.822 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -74.54 -177.34 3.28 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.719 2.28 . . . . 0.72 111.307 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.3 p -78.39 165.15 24.15 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.877 -0.329 . . . . 1.09 110.719 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -57.52 -40.88 79.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.895 0.378 . . . . 2.13 110.957 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.07 -45.53 92.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.8 110.809 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -63.41 -36.55 84.12 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.443 -0.799 . . . . 0.81 111.059 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.7 tp -72.36 -38.29 68.6 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.266 -0.425 . . . . 0.94 110.174 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -59.89 -46.2 90.11 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.594 -0.73 . . . . 1.31 110.316 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -64.52 -37.1 86.37 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.498 -0.774 . . . . 1.42 110.792 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 4.1 mmm -63.42 -46.41 86.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.905 -0.588 . . . . 0.78 112.504 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.475 ' O ' HG12 ' A' ' 55' ' ' VAL . 8.4 tp -72.1 -25.97 24.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 120.536 -0.466 . . . . 1.05 110.153 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -75.13 -21.74 58.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.65 0.738 . . . . 1.4 109.667 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.59 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 24.0 tt0 -84.08 -7.09 59.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.855 -1.066 . . . . 1.58 111.058 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.843 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -118.29 -48.95 3.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.451 -0.341 . . . . 1.37 111.234 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.623 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 19.7 t70 -75.01 101.43 4.48 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.781 0.324 . . . . 0.7 110.296 -179.482 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -7.86 56.09 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.044 -0.526 . . . . 1.17 111.535 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.02 -27.85 39.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.989 0.423 . . . . 0.85 111.094 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 92.99 44.8 3.75 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.681 -0.771 . . . . 1.03 114.705 177.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -144.61 -11.97 0.59 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.282 0.541 . . . . 2.17 111.138 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 75.49 26.08 66.44 Favored Glycine 0 C--N 1.33 0.239 0 C-N-CA 120.701 -0.761 . . . . 0.73 112.582 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 93.8 m -138.89 134.83 33.77 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.097 0.475 . . . . 0.9 110.97 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.473 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 0.4 OUTLIER -119.38 119.31 60.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.553 -0.748 . . . . 0.95 110.313 178.59 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -95.08 -173.17 2.88 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.646 -0.706 . . . . 1.09 110.043 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.513 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 15.1 m-85 -56.6 -52.97 69.4 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.368 -0.378 . . . . 2.05 111.498 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.513 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.7 Cg_endo -54.21 -37.2 87.79 Favored 'Trans proline' 0 C--N 1.364 1.365 0 C-N-CA 122.622 2.215 . . . . 0.85 112.258 178.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.648 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 29.1 mt-10 -72.95 -46.01 54.83 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.193 0.52 . . . . 0.66 110.481 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -59.29 -37.46 77.74 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.3 -0.864 . . . . 0.91 111.041 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 62.9 mt -59.65 -30.02 68.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.993 -0.549 . . . . 1.23 111.808 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.82 -37.6 10.67 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.194 0.521 . . . . 1.14 110.987 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.501 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 14.4 tpt -59.96 -48.94 79.63 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.596 -0.729 . . . . 1.24 112.102 -179.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.423 ' HE1' ' HB3' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -88.87 26.09 1.63 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.88 0.326 . . . . 0.99 111.88 -178.484 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -132.02 -36.85 1.16 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.998 0.428 . . . . 1.21 111.342 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -83.31 63.68 7.38 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.766 0.317 . . . . 2.96 111.733 -178.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.4 ptmm? -73.78 138.69 44.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.259 -0.428 . . . . 3.81 110.374 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -69.61 168.86 13.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.411 -0.359 . . . . 3.21 110.311 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -84.03 -16.61 43.29 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.08 0.467 . . . . 2.74 110.589 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -103.65 139.55 38.78 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.569 -0.53 . . . . 2.35 109.569 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.2 m -110.87 136.66 49.57 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.927 -0.579 . . . . 3.53 110.721 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 . . . . . 0 C--O 1.254 1.339 0 CA-C-O 118.557 -0.735 . . . . 3.21 110.343 -179.878 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . 0.59 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 110.28 -0.267 . . . . 3.73 110.28 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . . . . . . . . . . . -59.93 -31.32 69.74 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-O 120.715 0.293 . . . . 1.26 110.753 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . 0.502 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -68.57 -14.08 62.77 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 120.844 -0.342 . . . . 1.22 111.435 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . 0.494 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 3.5 m120 -102.68 -38.97 7.25 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.01 0.909 . . . . 0.96 109.292 175.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 1.1 mp -73.57 -10.28 59.55 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.944 -0.571 . . . . 1.85 111.155 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.843 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 2.6 m0 -87.15 -52.66 0.41 Allowed Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 107.766 -1.198 . . . . 0.54 107.766 175.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.502 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 12.8 Cg_exo -51.55 -33.82 49.66 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 123.454 2.77 . . . . 0.58 112.903 174.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.557 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 14.4 t -58.1 -60.11 11.13 Favored Pre-proline 0 CA--C 1.547 0.845 0 CA-C-O 119.203 -0.427 . . . . 1.39 110.903 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.598 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 78.8 Cg_exo -55.61 -34.37 89.94 Favored 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 122.025 1.816 . . . . 0.6 111.887 176.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 9.4 tp -65.35 -33.66 76.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.187 0.517 . . . . 1.08 109.745 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 2.7 ttt -67.84 -32.99 73.9 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.472 -0.936 . . . . 2.31 108.472 177.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 48.5 mm -69.99 -37.2 71.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.343 -0.984 . . . . 1.13 108.343 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . 0.556 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.1 OUTLIER -63.45 -42.23 98.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.169 -0.923 . . . . 1.11 109.264 178.092 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -40.34 94.38 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.258 -0.645 . . . . 2.87 109.258 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 53.7 m -64.54 -39.25 93.41 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.712 -0.676 . . . . 0.91 110.022 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -69.69 -34.61 74.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.086 -0.506 . . . . 2.89 109.89 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -66.44 -28.46 68.62 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.711 0.767 . . . . 1.29 109.503 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -85.5 -36.65 20.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.965 -1.016 . . . . 1.36 109.984 178.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 11.7 m . . . . . 0 C--O 1.255 1.35 0 CA-C-O 118.845 -0.598 . . . . 1.39 110.039 179.083 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' ' CA' . . . . . 0.647 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' ' CA' . . . . . 0.648 'CA ' ' OE1' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.404 ' HB1' ' OE1' ' A' ' 3' ' ' GLN . . . . . . . . 0 N--CA 1.475 0.776 0 N-CA-C 109.595 -0.52 . . . . 2.97 109.595 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -80.93 85.73 6.18 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.113 0.482 . . . . 3.47 111.72 -179.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.404 ' OE1' ' HB1' ' A' ' 1' ' ' ALA . 8.2 mp0 -129.26 -77.22 0.55 Allowed 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.145 -0.687 . . . . 3.53 109.145 178.239 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.9 mt -92.07 51.77 1.86 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.441 -0.8 . . . . 2.32 110.657 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.44 -71.82 0.23 Allowed 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.704 -0.68 . . . . 1.92 110.42 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.423 ' HA ' HD13 ' A' ' 9' ' ' ILE . 24.1 mm-40 42.82 67.0 0.67 Allowed 'General case' 0 N--CA 1.47 0.527 0 O-C-N 123.722 0.639 . . . . 1.44 111.014 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.14 -54.34 2.01 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.745 0.307 . . . . 1.4 111.704 -178.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -88.47 -29.15 20.37 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.071 -0.513 . . . . 1.75 110.79 -178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.457 ' H ' HG13 ' A' ' 9' ' ' ILE . 2.0 mt -56.26 -21.47 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-N 115.73 -0.668 . . . . 1.55 111.82 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.01 -34.63 68.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.876 -0.602 . . . . 1.26 112.061 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -86.11 -21.47 27.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.709 -0.223 . . . . 1.18 111.398 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -71.23 -42.68 68.57 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 120.993 0.425 . . . . 1.8 111.537 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.408 ' HZ2' ' CD ' ' A' ' 6' ' ' GLU . 80.1 mttt -68.73 -19.81 64.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.084 -0.507 . . . . 1.39 110.049 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.52 ' HG3' HD11 ' A' ' 18' ' ' LEU . 2.2 tp10 -69.61 -30.79 68.61 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.455 -0.793 . . . . 1.29 110.295 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.493 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -61.04 -46.0 92.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.297 -0.411 . . . . 0.85 110.113 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -84.52 29.29 0.6 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.107 0.48 . . . . 1.25 110.779 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.7 m -137.06 -38.17 0.63 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.947 -0.569 . . . . 0.94 110.712 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.52 HD11 ' HG3' ' A' ' 14' ' ' GLU . 23.3 mt -109.46 -37.91 5.6 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 111.998 0.37 . . . . 0.89 111.998 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.493 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 78.1 t80 -67.26 -43.45 81.83 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.817 0.341 . . . . 1.03 110.396 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.638 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 25.5 t70 -92.29 144.62 25.21 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.002 -0.74 . . . . 0.59 109.002 178.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -119.37 -2.58 10.58 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.784 -0.367 . . . . 2.09 111.761 -178.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.596 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 0.3 OUTLIER -93.23 -42.0 9.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.034 0.445 . . . . 0.82 110.547 -178.541 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 119.48 0.49 13.98 Favored Glycine 0 N--CA 1.442 -0.964 0 CA-C-N 115.456 -0.793 . . . . 0.87 111.651 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -75.61 -46.61 30.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.79 0.329 . . . . 0.74 111.155 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.99 26.22 41.96 Favored Glycine 0 CA--C 1.518 0.267 0 CA-C-N 116.264 -0.425 . . . . 1.3 112.295 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.9 152.05 31.34 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 110.4 -0.222 . . . . 1.11 110.4 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.696 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 10.7 mt -94.53 105.83 17.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.395 0.617 . . . . 0.76 110.802 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.86 165.84 17.33 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 114.786 -1.097 . . . . 1.12 109.215 178.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.82 -33.94 51.53 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.239 0.459 . . . . 1.08 112.239 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -61.85 -46.08 91.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.083 -0.508 . . . . 0.77 112.043 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.66 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 48.7 mp0 -77.12 -25.01 51.65 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.886 0.374 . . . . 0.87 110.95 -178.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.444 HD21 ' CE ' ' A' ' 51' ' ' MET . 18.3 tp -76.23 -47.25 24.63 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 116.031 -0.532 . . . . 1.12 110.271 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.99 -36.83 86.96 Favored Glycine 0 C--N 1.333 0.371 0 CA-C-N 115.637 -0.711 . . . . 0.36 114.091 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 p -59.94 -31.49 69.91 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 117.285 0.543 . . . . 0.54 112.406 -178.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.8 t -72.93 -53.42 18.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.811 -0.44 . . . . 1.97 109.811 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.404 ' HE2' ' HE1' ' A' ' 51' ' ' MET . 23.9 mtt -58.73 -41.22 85.89 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.734 -0.666 . . . . 1.24 111.457 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.45 ' HG3' ' HB2' ' A' ' 42' ' ' ASN . 1.1 ttt180 -59.49 -43.06 93.42 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.373 -0.376 . . . . 2.37 111.059 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 69.0 m -85.33 -3.69 58.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.978 0.418 . . . . 0.99 111.848 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.0 tp -100.93 -62.13 1.28 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.806 0.336 . . . . 1.21 111.295 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -149.08 62.97 0.41 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.528 -0.844 . . . . 0.56 112.726 -178.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 69.5 158.64 0.17 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.579 0.704 . . . . 3.6 112.043 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.45 ' HB2' ' HG3' ' A' ' 37' ' ' ARG . 3.9 t30 -105.94 135.01 19.48 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.838 -0.619 . . . . 0.96 110.57 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -75.95 -168.04 0.51 Allowed 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.344 2.029 . . . . 0.72 111.45 178.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.5 p -80.39 165.92 21.77 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 110.311 -0.255 . . . . 1.09 110.311 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -65.19 -32.72 74.54 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.556 -0.535 . . . . 2.13 109.556 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.5 -50.09 71.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.726 -0.67 . . . . 0.8 110.15 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -64.92 -33.94 77.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.774 -0.648 . . . . 0.81 110.606 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 47.8 tp -62.81 -38.35 90.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.467 -0.788 . . . . 0.94 110.358 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.526 ' O ' HG22 ' A' ' 52' ' ' ILE . 6.6 tt0 -77.74 -42.07 35.53 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.885 -0.598 . . . . 1.31 110.123 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -59.51 -29.41 67.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.189 0.518 . . . . 1.42 110.455 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.464 ' SD ' ' HA ' ' B' ' 288' ' ' ALA . 1.7 mmm -69.21 -35.38 76.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.916 -0.584 . . . . 0.78 110.853 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.526 HG22 ' O ' ' A' ' 49' ' ' GLN . 5.0 tp -80.85 -13.09 12.8 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-O 121.467 0.651 . . . . 1.05 109.546 179.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -81.16 -27.18 35.54 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.497 -0.774 . . . . 1.4 109.32 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.598 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 22.3 tt0 -94.41 36.37 1.16 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.584 -0.734 . . . . 1.58 110.274 178.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.766 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 7.1 p -164.59 -32.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 C-N-CA 119.965 -0.694 . . . . 1.37 112.592 -177.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -93.09 80.13 4.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.99 0.424 . . . . 0.7 110.303 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.72 -28.46 61.05 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.55 -0.75 . . . . 1.17 112.791 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -69.48 -14.48 62.9 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.881 0.372 . . . . 0.85 110.828 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.55 51.48 58.47 Favored Glycine 0 C--N 1.333 0.373 0 CA-C-N 116.277 -0.42 . . . . 1.03 113.044 178.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -124.29 -25.7 4.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.17 0.51 . . . . 2.17 110.376 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.2 14.59 47.83 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.799 -0.637 . . . . 0.73 111.891 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.5 m -152.42 139.06 18.75 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 120.995 0.426 . . . . 0.9 111.379 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.494 HD11 ' CH2' ' B' ' 292' ' ' TRP . 0.4 OUTLIER -116.13 118.52 59.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 108.737 -0.838 . . . . 0.95 108.737 178.347 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -91.81 -172.39 3.18 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.645 -0.502 . . . . 1.09 109.645 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.49 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 31.0 m-85 -55.88 -53.92 57.8 Favored Pre-proline 0 CA--C 1.532 0.263 0 O-C-N 123.085 0.24 . . . . 2.05 111.17 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.7 Cg_endo -50.93 -43.18 48.86 Favored 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 122.236 1.957 . . . . 0.85 112.02 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.652 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 20.2 mt-10 -69.69 -43.22 72.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.362 -0.381 . . . . 0.66 110.759 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -56.77 -40.98 76.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.833 -0.621 . . . . 0.91 111.335 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.29 -34.75 77.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.686 -0.688 . . . . 1.23 110.7 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.7 m -81.79 -41.82 20.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.132 -0.485 . . . . 1.14 111.137 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.486 ' HE1' ' HA ' ' B' ' 289' ' ' ALA . 5.6 tpt -61.92 -50.09 73.58 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.516 0.562 . . . . 1.24 112.516 -178.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.67 -15.1 61.71 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.12 -0.632 . . . . 0.99 112.367 -178.162 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -96.69 -13.16 22.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.141 0.496 . . . . 1.21 110.262 178.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -82.82 66.7 8.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.741 -0.663 . . . . 2.96 110.307 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -79.06 143.05 35.97 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.89 -0.596 . . . . 3.81 111.001 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 3.0 mpp? -104.27 158.16 16.64 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.835 -0.621 . . . . 3.21 110.935 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -90.04 2.95 54.61 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.855 -0.611 . . . . 2.74 109.839 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.43 153.74 43.08 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.626 -0.716 . . . . 2.35 110.261 -178.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.4 m -81.41 101.39 9.82 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.941 -0.572 . . . . 3.53 109.954 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.328 -0.844 . . . . 3.21 110.02 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . 0.598 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 5.2 ttm180 . . . . . 0 N--CA 1.477 0.899 0 CA-C-O 120.718 0.294 . . . . 3.73 110.556 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . 0.655 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -63.21 -31.61 72.8 Favored 'General case' 0 C--O 1.216 -0.709 0 N-CA-C 112.621 0.6 . . . . 1.26 112.621 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . 0.519 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -63.64 -3.52 2.31 Favored 'General case' 0 C--O 1.216 -0.658 0 N-CA-C 113.335 0.865 . . . . 1.22 113.335 -179.394 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -111.42 -35.97 5.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 122.286 1.041 . . . . 0.96 109.973 177.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . 0.4 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 8.2 mp -80.22 -8.36 59.41 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 114.077 -1.419 . . . . 1.85 109.979 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.766 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 6.5 m0 -90.72 -54.56 0.28 Allowed Pre-proline 0 CA--C 1.535 0.394 0 N-CA-C 107.176 -1.416 . . . . 0.54 107.176 175.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.519 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 21.4 Cg_exo -50.77 -32.81 38.16 Favored 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 122.751 2.301 . . . . 0.58 112.571 174.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.539 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 19.5 t -59.78 -61.76 7.24 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-O 119.124 -0.465 . . . . 1.39 110.688 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.539 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 93.1 Cg_exo -52.06 -36.23 64.77 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 121.594 1.529 . . . . 0.6 112.215 176.221 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 14.2 tp -65.21 -32.68 74.48 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.347 0.594 . . . . 1.08 109.735 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 17.7 ttt -73.31 -45.36 55.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.208 -0.906 . . . . 2.31 108.926 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 46.2 mm -61.1 -33.65 56.92 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 N-CA-C 108.881 -0.785 . . . . 1.13 108.881 178.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . 0.553 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.2 OUTLIER -62.95 -43.85 97.65 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.18 -0.918 . . . . 1.11 109.105 178.21 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -41.62 89.7 Favored 'General case' 0 C--N 1.333 -0.113 0 N-CA-C 108.945 -0.761 . . . . 2.87 108.945 178.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 67.9 m -65.01 -42.86 94.06 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.619 -0.719 . . . . 0.91 110.676 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 22.5 tptp -67.49 -36.24 80.72 Favored 'General case' 0 C--O 1.225 -0.219 0 N-CA-C 110.014 -0.365 . . . . 2.89 110.014 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 3.2 tttp -63.48 -30.45 71.57 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.942 -0.762 . . . . 1.29 108.942 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -82.07 -31.59 30.74 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.099 -0.955 . . . . 1.36 109.907 178.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.8 m . . . . . 0 C--O 1.247 0.926 0 CA-C-N 115.453 -0.794 . . . . 1.39 111.216 179.827 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' ' CA' . . . . . 0.66 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' ' CA' . . . . . 0.652 'CA ' ' OE1' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 109.859 -0.423 . . . . 2.97 109.859 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -84.93 103.21 13.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.212 0.53 . . . . 3.47 110.732 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -132.09 -56.46 0.98 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.492 -0.776 . . . . 3.53 110.051 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 73.8 mt -85.12 75.02 10.39 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.204 0.526 . . . . 2.32 110.42 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.86 -85.36 0.06 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.444 -0.798 . . . . 1.92 111.278 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 52.31 50.12 19.05 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.448 0.642 . . . . 1.44 110.151 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.467 ' CD ' ' H ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -116.93 -56.17 2.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.077 -0.965 . . . . 1.4 109.988 -179.22 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.467 ' H ' ' CD ' ' A' ' 7' ' ' GLU . 40.2 mt-30 -93.42 -34.23 13.52 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.094 -0.706 . . . . 1.75 109.094 179.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.429 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 2.6 mt -63.88 -25.36 38.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.254 -0.885 . . . . 1.55 110.317 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.79 -35.58 81.07 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.351 -0.386 . . . . 1.26 111.265 -179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.04 -25.83 36.83 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.016 0.436 . . . . 1.18 110.063 179.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.425 ' CD2' ' HA ' ' A' ' 9' ' ' ILE . 22.1 m-30 -69.25 -32.72 72.13 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.439 0.637 . . . . 1.8 109.317 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.8 mttt -70.34 -20.23 63.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.294 -0.866 . . . . 1.39 111.202 179.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.508 ' HG3' HD11 ' A' ' 18' ' ' LEU . 3.7 tp10 -66.94 -24.61 66.1 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 109.181 -0.674 . . . . 1.29 109.181 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.419 ' O ' ' HB2' ' A' ' 19' ' ' PHE . . . -69.28 -37.42 77.85 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.743 -0.466 . . . . 0.85 109.743 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -86.59 14.98 6.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.883 0.373 . . . . 1.25 110.754 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.3 m -129.03 -35.45 1.84 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.952 0.406 . . . . 0.94 110.914 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.508 HD11 ' HG3' ' A' ' 14' ' ' GLU . 44.6 mt -99.37 -28.55 13.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.277 -0.419 . . . . 0.89 111.938 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.419 ' HB2' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -80.93 -57.6 3.47 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.225 0.536 . . . . 1.03 110.005 -179.012 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.641 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 31.1 t70 -82.4 142.0 32.32 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.004 -0.998 . . . . 0.59 111.146 -179.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -128.89 6.8 5.53 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.104 -0.702 . . . . 2.09 109.104 178.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.624 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 3.9 m-20 -95.08 -25.72 16.34 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.849 -0.614 . . . . 0.82 111.643 -178.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.05 22.14 23.64 Favored Glycine 0 N--CA 1.442 -0.914 0 N-CA-C 110.709 -0.956 . . . . 0.87 110.709 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.636 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 2.5 p30 -95.8 -32.8 12.52 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.641 -0.503 . . . . 0.74 109.641 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.16 28.74 73.82 Favored Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.863 -0.684 . . . . 1.3 112.878 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.5 p -132.35 128.16 37.06 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 122.932 -0.158 . . . . 1.11 111.227 -179.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.575 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 47.9 mt -75.14 112.19 12.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 120.97 0.414 . . . . 0.76 111.379 -179.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.5 p -117.8 177.87 4.61 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.417 -0.811 . . . . 1.12 108.815 178.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.423 HG21 ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -58.02 -28.24 64.27 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.779 0.323 . . . . 1.08 111.143 178.207 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 44.6 tttt -65.88 -44.63 84.78 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 112.175 0.435 . . . . 0.77 112.175 -179.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.649 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 55.3 mp0 -78.98 -22.03 46.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.95 0.405 . . . . 0.87 111.143 -178.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.4 tp -83.46 -38.66 21.55 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.096 -0.502 . . . . 1.12 110.748 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.18 -32.75 51.45 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.736 -0.745 . . . . 0.36 113.619 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -60.41 -44.91 95.25 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.272 0.471 . . . . 0.54 112.272 -178.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.5 p -66.5 -48.33 80.9 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 120.978 -0.289 . . . . 1.97 110.734 -178.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 56.6 mtt -56.56 -46.38 80.75 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.718 0.294 . . . . 1.24 111.538 178.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -58.39 -29.5 66.09 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.172 -0.467 . . . . 2.37 111.313 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.0 m -99.05 3.88 46.92 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.13 -0.486 . . . . 0.99 111.337 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.5 tp -113.97 -34.14 5.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.314 -0.403 . . . . 1.21 111.408 -178.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -169.3 53.23 0.21 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.225 -0.988 . . . . 0.56 112.829 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 72.89 175.9 0.27 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.495 0.664 . . . . 3.6 111.894 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -116.76 123.72 30.07 Favored Pre-proline 0 C--N 1.318 -0.791 0 CA-C-N 115.273 -0.876 . . . . 0.96 109.56 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -77.48 -163.92 0.24 Allowed 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.162 1.908 . . . . 0.72 111.106 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.6 p -82.55 158.97 22.91 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.01 -0.676 . . . . 1.09 110.195 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.3 mp0 -57.15 -35.28 69.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.97 -0.559 . . . . 2.13 110.533 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.3 -46.14 91.54 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.425 0.631 . . . . 0.8 110.165 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -64.96 -41.11 95.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.216 -0.902 . . . . 0.81 110.37 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.423 ' HG ' HG21 ' A' ' 29' ' ' THR . 18.9 tp -65.05 -43.08 93.48 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.738 -0.664 . . . . 0.94 110.216 179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -66.59 -46.76 74.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.288 -0.415 . . . . 1.31 110.66 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -56.18 -35.5 67.31 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.044 0.45 . . . . 1.42 110.741 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.447 ' SD ' HD11 ' B' ' 291' ' ' LEU . 2.9 mmm -66.72 -45.96 77.01 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.504 -0.771 . . . . 0.78 111.265 -179.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.456 ' O ' HG12 ' A' ' 55' ' ' VAL . 8.9 tp -69.5 -22.99 25.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-O 121.096 0.474 . . . . 1.05 110.251 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.54 -24.97 41.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.675 0.75 . . . . 1.4 109.193 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.409 ' HB3' ' HB2' ' B' ' 288' ' ' ALA . 9.1 tp10 -77.41 -9.54 58.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.01 -0.995 . . . . 1.58 110.372 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.803 HG23 ' CZ2' ' B' ' 292' ' ' TRP . 0.7 OUTLIER -118.9 -49.72 3.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.292 -0.413 . . . . 1.37 111.849 -179.699 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.647 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 30.2 t70 -79.4 103.8 9.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 0.7 110.841 -178.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.32 -25.69 46.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.867 -0.606 . . . . 1.17 112.598 -178.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -64.14 -39.25 93.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.683 -0.235 . . . . 0.85 111.419 -179.031 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 101.99 31.21 5.46 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.38 -0.914 . . . . 1.03 113.332 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -127.86 -6.04 5.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.84 0.352 . . . . 2.17 110.807 179.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.48 34.69 88.51 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.663 -0.779 . . . . 0.73 112.252 179.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.7 m -142.74 131.69 22.96 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 110.014 -0.365 . . . . 0.9 110.014 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.513 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 0.1 OUTLIER -113.35 121.71 66.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.141 0.496 . . . . 0.95 111.16 179.662 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -92.43 -176.96 4.47 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.488 -0.778 . . . . 1.09 110.747 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.504 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 36.1 m-85 -52.92 -54.9 38.7 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 116.467 -0.333 . . . . 2.05 111.788 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.407 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.8 Cg_endo -59.13 -32.57 97.47 Favored 'Trans proline' 0 C--N 1.36 1.152 0 C-N-CA 122.121 1.881 . . . . 0.85 113.674 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.617 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 38.0 mt-10 -70.39 -42.88 71.12 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.252 0.549 . . . . 0.66 110.296 -178.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -66.68 -44.34 82.01 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.584 -0.734 . . . . 0.91 110.73 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 81.4 mt -59.73 -29.62 68.26 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.427 -0.352 . . . . 1.23 111.409 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.7 m -81.92 -44.6 16.58 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.097 0.406 . . . . 1.14 112.097 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.648 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 24.5 ttt -67.27 -49.73 63.22 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.676 0.621 . . . . 1.24 112.676 -178.235 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.409 ' HE1' ' HB3' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -74.34 3.45 7.35 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.892 0.701 . . . . 0.99 112.892 -178.122 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -115.44 -11.08 11.88 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.257 0.551 . . . . 1.21 109.997 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.66 58.53 5.09 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.473 -0.785 . . . . 2.96 110.173 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.2 ptmm? -78.15 133.34 37.83 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.983 -0.553 . . . . 3.81 111.391 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 5.2 mpp? -89.32 -175.53 4.78 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.789 -0.641 . . . . 3.21 109.598 179.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -101.17 -4.03 28.0 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.494 -0.928 . . . . 2.74 108.494 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -68.94 145.36 53.7 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 114.297 -1.319 . . . . 2.35 110.377 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.2 m -116.08 104.92 12.04 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.136 -0.484 . . . . 3.53 110.84 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 C--O 1.245 0.821 0 CA-C-O 118.454 -0.784 . . . . 3.21 110.03 179.119 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . 0.415 ' HB3' ' OD1' ' B' ' 290' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 109.488 -0.56 . . . . 3.73 109.488 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . 0.409 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . . . -72.25 -24.8 61.42 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-O 121.232 0.539 . . . . 1.26 110.975 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . 0.648 ' HA ' ' CE ' ' A' ' 71' ' ' MET . . . -68.53 -0.55 5.21 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.219 0.822 . . . . 1.22 113.219 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . 0.513 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 2.9 m120 -114.38 -36.47 4.63 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 123.233 1.492 . . . . 0.96 109.745 176.105 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . 0.447 HD11 ' SD ' ' A' ' 51' ' ' MET . 6.4 mt -80.82 -3.06 49.76 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 113.018 -1.901 . . . . 1.85 111.156 -178.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.803 ' CZ2' HG23 ' A' ' 55' ' ' VAL . 3.1 m0 -100.04 -52.7 0.18 Allowed Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 107.449 -1.315 . . . . 0.54 107.449 174.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.575 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 11.6 Cg_exo -49.54 -39.05 45.75 Favored 'Trans proline' 0 C--N 1.376 1.978 0 C-N-CA 122.969 2.446 . . . . 0.58 111.545 175.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.43 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 3.1 t -60.83 -64.05 3.58 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 108.617 -0.883 . . . . 1.39 108.617 177.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.43 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 2.8 Cg_exo -47.3 -36.17 22.16 Favored 'Trans proline' 0 C--N 1.359 1.11 0 C-N-CA 122.599 2.2 . . . . 0.6 112.834 174.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 13.0 tp -70.85 -37.49 73.14 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 120.725 0.298 . . . . 1.08 110.528 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 14.6 ttt -65.08 -36.25 83.74 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.522 -0.918 . . . . 2.31 108.522 178.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 30.9 mm -66.07 -37.52 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-N 114.776 -1.102 . . . . 1.13 108.434 176.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . 0.519 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.2 OUTLIER -65.08 -40.99 95.44 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 108.684 -0.858 . . . . 1.11 108.684 177.355 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 16.9 mtp180 -61.91 -38.69 89.33 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.04 -0.726 . . . . 2.87 109.04 178.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 67.2 m -64.03 -45.21 89.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.562 -0.745 . . . . 0.91 110.339 178.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 15.6 tptp -68.56 -30.6 69.41 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.101 0.476 . . . . 2.89 109.863 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 6.1 tttp -68.2 -31.23 70.61 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.896 0.855 . . . . 1.29 108.796 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -77.41 -40.05 44.92 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.66 -1.155 . . . . 1.36 108.932 177.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 C--O 1.247 0.963 0 CA-C-N 115.61 -0.723 . . . . 1.39 111.025 178.836 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' ' CA' . . . . . 0.649 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' ' CA' . . . . . 0.647 'CA ' ' OD1' ' A' ' 56' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.993 0 N-CA-C 110.207 -0.294 . . . . 2.97 110.207 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -79.07 70.55 5.45 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.22 0.533 . . . . 3.47 111.405 -179.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -102.34 -55.06 2.54 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.876 -0.602 . . . . 3.53 109.48 179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 89.7 mt -97.75 76.94 2.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.53 -0.759 . . . . 2.32 110.303 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.0 p -75.66 -82.14 0.07 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.478 -0.783 . . . . 1.92 110.971 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 49.03 47.16 22.12 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.837 -0.62 . . . . 1.44 111.3 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.06 -55.0 2.57 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.014 -0.539 . . . . 1.4 109.955 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -94.9 -32.96 12.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.446 0.641 . . . . 1.75 109.528 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.419 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 4.5 mt -58.11 -26.96 30.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.277 -0.874 . . . . 1.55 111.037 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.37 -32.15 73.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.097 -0.501 . . . . 1.26 110.844 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.413 ' CD ' ' HZ3' ' B' ' 299' ' ' LYS . 1.2 mm-40 -81.31 -27.97 34.79 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.27 -0.423 . . . . 1.18 110.734 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -72.38 -36.62 68.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.841 -0.618 . . . . 1.8 109.79 178.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 91.4 mttt -67.89 -26.4 65.98 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.824 -0.626 . . . . 1.39 110.227 179.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.489 ' HG2' ' HE3' ' B' ' 299' ' ' LYS . 4.9 tp10 -60.78 -33.63 73.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.54 -0.754 . . . . 1.29 109.939 178.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.01 -41.5 99.57 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.921 -0.581 . . . . 0.85 109.741 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -77.1 3.03 13.44 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.214 -0.448 . . . . 1.25 111.56 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 7.5 m -117.54 -36.98 3.56 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.194 -0.457 . . . . 0.94 111.486 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.458 HD11 ' HG3' ' A' ' 14' ' ' GLU . 89.1 mt -96.3 -20.09 18.78 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.102 0.408 . . . . 0.89 112.102 -179.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -85.86 -53.62 5.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.9 0.381 . . . . 1.03 110.216 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.66 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 23.6 t70 -83.06 142.58 31.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.481 -0.781 . . . . 0.59 111.631 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.8 mptt -127.77 -10.06 5.54 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.999 -0.546 . . . . 2.09 110.622 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.604 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 0.4 OUTLIER -78.81 -41.46 30.2 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 120.983 0.421 . . . . 0.82 110.198 -178.871 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 115.94 1.62 20.81 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 111.187 -0.765 . . . . 0.87 111.187 -178.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -72.47 -36.09 68.38 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.885 -0.413 . . . . 0.74 109.885 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.54 35.78 62.74 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.871 -0.68 . . . . 1.3 112.467 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.76 145.7 38.59 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 110.273 -0.269 . . . . 1.11 110.273 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.623 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 65.1 mt -87.91 111.29 21.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 C-N-CA 120.661 -0.416 . . . . 0.76 110.793 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.3 p -123.65 -177.5 3.75 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.777 -0.823 . . . . 1.12 108.777 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.75 -30.94 66.0 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.474 0.546 . . . . 1.08 112.474 179.015 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -64.32 -48.23 76.41 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.03 0.752 . . . . 0.77 113.03 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.651 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 51.1 mp0 -79.31 -22.52 44.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.449 0.642 . . . . 0.87 110.954 -177.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.454 HD23 ' HE3' ' A' ' 51' ' ' MET . 35.8 tp -74.33 -35.97 63.64 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.2 -0.909 . . . . 1.12 110.742 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -88.26 -29.17 20.55 Favored Glycine 0 CA--C 1.518 0.246 0 C-N-CA 120.786 -0.721 . . . . 0.36 113.099 -179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -60.78 -40.97 94.56 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.944 0.372 . . . . 0.54 111.541 -178.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.577 HG13 ' N ' ' A' ' 36' ' ' MET . 14.5 p -68.96 -48.29 71.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.523 -0.308 . . . . 1.97 110.403 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.577 ' N ' HG13 ' A' ' 35' ' ' VAL . 61.6 mtt -60.22 -42.27 94.81 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.675 -0.239 . . . . 1.24 111.267 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -35.07 74.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.306 -0.406 . . . . 2.37 110.769 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.7 m -91.09 0.35 57.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.259 -0.428 . . . . 0.99 111.367 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.3 tp -103.92 -57.89 1.96 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.782 0.325 . . . . 1.21 110.983 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -151.19 45.67 0.63 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.675 -0.774 . . . . 0.56 111.899 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 71.21 155.96 0.15 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.423 0.689 . . . . 3.6 110.984 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -106.6 138.0 19.63 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.25 -0.432 . . . . 0.96 110.853 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.38 -164.45 0.16 Allowed 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 122.572 2.181 . . . . 0.72 111.421 178.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.1 p -75.86 163.51 27.15 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.835 -0.346 . . . . 1.09 110.363 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -62.96 -30.45 71.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.045 -0.525 . . . . 2.13 110.963 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.87 -42.61 99.83 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.151 0.5 . . . . 0.8 110.667 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -71.56 -36.28 70.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.776 -0.647 . . . . 0.81 110.107 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 59.6 tp -64.14 -45.76 87.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.619 -0.718 . . . . 0.94 110.381 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -69.11 -32.13 71.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.952 0.405 . . . . 1.31 110.829 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -69.71 -38.98 77.13 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.302 -0.408 . . . . 1.42 110.155 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.454 ' HE3' HD23 ' A' ' 32' ' ' LEU . 4.9 mmm -57.5 -46.35 83.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.72 -0.673 . . . . 0.78 112.125 -179.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.404 ' HA ' ' CG1' ' A' ' 55' ' ' VAL . 8.8 tp -69.16 -22.44 26.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 120.603 -0.439 . . . . 1.05 111.263 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -22.83 51.83 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.212 0.53 . . . . 1.4 109.6 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.59 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 7.3 tt0 -82.36 -18.73 41.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.678 -0.692 . . . . 1.58 110.665 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.862 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -103.72 -48.33 10.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.153 0.427 . . . . 1.37 112.153 -179.71 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.645 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 20.0 t70 -83.35 106.01 14.77 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.274 0.559 . . . . 0.7 110.932 -179.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.2 -20.4 28.6 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.503 -0.771 . . . . 1.17 112.057 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.34 -29.43 69.62 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 110.037 -0.357 . . . . 0.85 110.037 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 91.41 34.15 7.63 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.77 -0.729 . . . . 1.03 114.11 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -129.65 -5.96 4.64 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 122.512 -0.405 . . . . 2.17 110.187 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.11 13.57 64.73 Favored Glycine 0 C--N 1.336 0.57 0 C-N-CA 121.282 -0.485 . . . . 0.73 112.954 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 3.9 m -119.04 130.07 55.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.751 0.31 . . . . 0.9 110.51 -179.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.58 HD11 ' CH2' ' B' ' 292' ' ' TRP . 0.4 OUTLIER -121.21 120.0 60.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.962 -0.563 . . . . 0.95 110.685 178.96 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -99.2 -172.91 2.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.164 -0.925 . . . . 1.09 109.955 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.524 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 4.3 m-85 -54.07 -54.97 41.39 Favored Pre-proline 0 N--CA 1.466 0.366 0 C-N-CA 122.549 0.339 . . . . 2.05 111.593 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.8 Cg_endo -52.13 -42.13 61.06 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 122.684 2.256 . . . . 0.85 112.775 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.653 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 34.8 mt-10 -69.0 -48.08 63.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.66 110.373 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -58.58 -47.42 84.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.511 -0.768 . . . . 0.91 111.75 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 70.2 mt -59.3 -26.75 65.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.209 -0.45 . . . . 1.23 111.811 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.5 m -93.55 -36.42 12.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.523 -0.308 . . . . 1.14 110.995 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.436 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 6.5 tpt -62.63 -47.94 81.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 1.24 111.47 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.26 2.88 6.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.102 -0.499 . . . . 0.99 111.3 -179.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -119.8 11.88 11.99 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.212 0.53 . . . . 1.21 110.364 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.2 mmm180 -113.72 75.49 0.93 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.8 -0.636 . . . . 2.96 110.858 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.66 120.57 42.0 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.068 -0.514 . . . . 3.81 110.2 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 4.4 mpp? -61.16 158.02 14.8 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.628 -0.715 . . . . 3.21 109.751 178.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -77.51 66.44 3.24 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.149 0.5 . . . . 2.74 110.683 -179.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -132.51 144.03 50.16 Favored 'General case' 0 CA--C 1.506 -0.73 0 CA-C-N 115.566 -0.743 . . . . 2.35 110.106 -178.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.5 m -74.41 105.82 5.74 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.933 -0.576 . . . . 3.53 110.107 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.391 -0.814 . . . . 3.21 110.51 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . 0.59 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 1.5 ttm180 . . . . . 0 N--CA 1.479 1.005 0 N-CA-C 109.833 -0.432 . . . . 3.73 109.833 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . . . . . . . . . . . -57.95 -30.57 66.08 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 113.148 0.796 . . . . 1.26 113.148 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . 0.697 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -67.67 -15.27 63.56 Favored 'General case' 0 C--O 1.201 -1.478 0 CA-C-O 118.728 -0.653 . . . . 1.22 109.838 -178.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -98.45 -40.34 8.32 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 118.477 0.58 . . . . 0.96 110.884 174.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 9.0 mp -75.2 -9.91 58.98 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 115.545 -0.752 . . . . 1.85 111.263 -179.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.862 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 2.2 m95 -88.92 -54.59 0.32 Allowed Pre-proline 0 C--N 1.321 -0.638 0 N-CA-C 107.601 -1.259 . . . . 0.54 107.601 175.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.697 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 6.6 Cg_exo -48.02 -36.76 28.6 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 123.653 2.902 . . . . 0.58 113.141 174.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.503 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 12.5 t -59.39 -62.03 6.67 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 119.126 -0.464 . . . . 1.39 111.332 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.503 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 92.7 Cg_exo -51.33 -35.87 55.48 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 122.016 1.811 . . . . 0.6 112.178 176.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 46.3 tp -66.95 -38.44 86.12 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.719 -0.474 . . . . 1.08 109.719 178.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 27.5 ttt -63.53 -37.07 85.91 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.52 -0.919 . . . . 2.31 108.52 177.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 44.0 mm -64.33 -38.99 83.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 108.379 -0.971 . . . . 1.13 108.379 177.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . 0.489 ' HE3' ' HG2' ' A' ' 14' ' ' GLU . 0.1 OUTLIER -62.16 -44.17 97.21 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.866 -0.606 . . . . 1.11 109.474 178.087 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -62.83 -38.2 89.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.743 -0.662 . . . . 2.87 109.769 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 22.7 m -67.75 -33.89 75.74 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.929 -0.578 . . . . 0.91 109.833 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -77.27 -29.68 54.01 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.14 -0.689 . . . . 2.89 109.14 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . 0.482 ' HG3' ' HG2' ' A' ' 14' ' ' GLU . 0.9 OUTLIER -70.51 -33.73 71.53 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 108.404 -0.962 . . . . 1.29 108.404 178.893 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -77.62 -40.54 41.61 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.34 -0.985 . . . . 1.36 108.34 177.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 3.5 m . . . . . 0 C--O 1.251 1.172 0 CA-C-N 115.768 -0.651 . . . . 1.39 111.221 177.858 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' ' CA' . . . . . 0.66 'CA ' ' OD1' ' A' ' 20' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' ' CA' . . . . . 0.653 'CA ' ' OE1' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.824 0 N-CA-C 109.88 -0.415 . . . . 2.97 109.88 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -77.79 -11.27 59.87 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.182 0.438 . . . . 3.47 112.182 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.81 -59.76 2.65 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 121.943 -0.473 . . . . 3.53 111.216 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.4 mt -86.18 79.0 9.25 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.077 0.465 . . . . 2.32 110.08 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.9 p -87.32 -72.8 0.5 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.36 -0.837 . . . . 1.92 110.778 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 52.21 56.4 7.79 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.631 -0.713 . . . . 1.44 111.275 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.39 -94.68 0.46 Allowed 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.468 -0.568 . . . . 1.4 109.468 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -60.02 -31.02 69.55 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.737 0.303 . . . . 1.75 110.19 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.4 ' HA ' ' CD2' ' A' ' 12' ' ' PHE . 14.8 mt -59.76 -35.73 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-O 121.004 0.43 . . . . 1.55 111.055 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.79 -31.3 69.14 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.43 0.634 . . . . 1.26 110.695 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -73.72 -21.63 60.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.538 0.685 . . . . 1.18 109.781 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.4 ' CD2' ' HA ' ' A' ' 9' ' ' ILE . 20.1 m-85 -76.36 -35.06 58.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.319 -0.855 . . . . 1.8 109.758 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.594 ' HA ' ' CD2' ' A' ' 16' ' ' PHE . 81.6 mttt -66.21 -28.85 69.06 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.498 0.666 . . . . 1.39 109.427 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.474 ' HB3' ' HZ2' ' B' ' 299' ' ' LYS . 3.8 tp10 -60.0 -36.81 78.0 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.775 -1.102 . . . . 1.29 110.851 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.449 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -64.49 -39.19 93.33 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.939 -0.573 . . . . 0.85 111.011 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.594 ' CD2' ' HA ' ' A' ' 13' ' ' LYS . 9.7 m-85 -65.75 -14.0 60.46 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.704 0.288 . . . . 1.25 111.444 -179.282 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 42.5 m -110.71 -36.03 5.83 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.382 0.512 . . . . 0.94 112.382 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.0 mt -91.93 -22.93 19.77 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.337 0.495 . . . . 0.89 112.337 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.449 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 84.8 t80 -91.55 -50.01 6.0 Favored 'General case' 0 C--N 1.327 -0.38 0 O-C-N 122.353 -0.217 . . . . 1.03 110.622 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.638 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 24.1 t70 -80.46 148.52 30.45 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.384 -0.371 . . . . 0.59 111.099 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -130.61 15.04 5.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.32 -0.4 . . . . 2.09 111.361 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -108.94 -38.34 5.61 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.063 0.459 . . . . 0.82 110.525 -178.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 122.64 -13.15 8.75 Favored Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 111.109 -0.797 . . . . 0.87 111.109 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -69.1 -39.52 78.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.424 -0.388 . . . . 0.74 110.986 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 75.18 24.96 69.88 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.873 -0.68 . . . . 1.3 112.903 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.489 HG21 ' HA ' ' A' ' 64' ' ' ASP . 22.5 p -119.7 156.26 30.83 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.935 0.368 . . . . 1.11 110.727 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.791 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 55.7 mt -96.14 108.35 21.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.027 0.441 . . . . 0.76 111.36 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.68 175.9 6.0 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.425 -0.807 . . . . 1.12 109.592 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.449 HG23 ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -53.43 -41.81 66.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.234 0.54 . . . . 1.08 111.892 179.916 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -58.03 -53.3 59.76 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.343 -0.844 . . . . 0.77 113.269 -178.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.653 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 18.4 mp0 -75.73 -23.49 56.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.679 0.276 . . . . 0.87 111.716 -177.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.465 HD11 ' CD1' ' B' ' 292' ' ' TRP . 14.4 tp -69.93 -49.98 46.6 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.05 -0.523 . . . . 1.12 109.966 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.563 ' O ' ' HB2' ' A' ' 37' ' ' ARG . . . -71.68 -36.91 61.83 Favored Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 115.47 -0.786 . . . . 0.36 113.634 -178.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.62 -41.23 89.94 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 117.825 0.813 . . . . 0.54 112.232 -178.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 72.7 t -71.93 -57.02 8.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.666 0.27 . . . . 1.97 110.918 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 36.3 mtt -58.43 -27.56 64.44 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.396 -0.365 . . . . 1.24 111.517 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.563 ' HB2' ' O ' ' A' ' 33' ' ' GLY . 43.6 ttt180 -62.97 -32.69 74.07 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.986 -0.552 . . . . 2.37 111.158 178.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.5 m -94.3 -3.98 49.54 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.955 -0.566 . . . . 0.99 111.373 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.4 tp -95.33 -42.35 8.56 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.251 -0.431 . . . . 1.21 110.858 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.455 ' O ' ' HB2' ' A' ' 41' ' ' GLN . . . -163.31 38.35 0.33 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.699 -0.763 . . . . 0.56 112.163 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.455 ' HB2' ' O ' ' A' ' 40' ' ' GLY . 1.2 mp0 71.79 154.01 0.13 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.449 0.642 . . . . 3.6 111.644 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -119.28 139.24 27.32 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.034 -0.53 . . . . 0.96 110.117 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -77.12 -157.76 0.07 OUTLIER 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.312 2.008 . . . . 0.72 113.045 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.0 p -77.73 160.85 28.15 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 122.045 -0.409 . . . . 1.09 111.911 -178.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -54.71 -31.53 58.28 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.744 -0.662 . . . . 2.13 110.865 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.4 -54.22 40.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 0.8 110.597 179.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -64.19 -34.02 77.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.746 -0.661 . . . . 0.81 110.515 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.449 ' HG ' HG23 ' A' ' 29' ' ' THR . 46.6 tp -67.71 -41.61 83.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.671 -0.695 . . . . 0.94 110.747 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.521 ' O ' HG22 ' A' ' 52' ' ' ILE . 23.0 tt0 -67.35 -32.23 73.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.169 -0.469 . . . . 1.31 110.144 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -66.87 -32.36 73.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.203 0.525 . . . . 1.42 109.922 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.438 ' HE3' HD22 ' A' ' 32' ' ' LEU . 1.4 mmm -64.61 -38.78 92.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.425 -0.807 . . . . 0.78 111.276 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.521 HG22 ' O ' ' A' ' 49' ' ' GLN . 6.9 tp -75.89 -12.64 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.152 0.501 . . . . 1.05 110.914 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -85.44 -21.75 28.6 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.932 -0.766 . . . . 1.4 108.932 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.664 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 11.4 tt0 -89.76 16.8 7.37 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.384 -1.28 . . . . 1.58 110.572 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.786 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 6.6 p -146.82 -38.6 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 120.094 -0.642 . . . . 1.37 112.557 -177.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.632 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 20.7 t70 -85.79 98.49 10.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.319 0.58 . . . . 0.7 109.716 178.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.4 -19.77 29.21 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 113.018 0.747 . . . . 1.17 113.018 -177.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -71.4 -36.62 71.44 Favored 'General case' 0 C--N 1.327 -0.39 0 O-C-N 122.444 -0.16 . . . . 0.85 110.821 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 101.25 49.0 1.37 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.204 -0.998 . . . . 1.03 113.839 178.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 27.0 p-10 -135.31 -14.53 1.98 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 117.111 0.456 . . . . 2.17 110.531 178.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 72.69 24.84 75.41 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 121.087 -0.577 . . . . 0.73 112.63 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 18.4 m -155.35 126.72 7.26 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.78 -0.452 . . . . 0.9 109.78 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.443 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 0.6 OUTLIER -100.47 108.85 23.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 120.456 -0.498 . . . . 0.95 110.479 179.829 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.489 ' HA ' HG21 ' A' ' 26' ' ' THR . 28.5 t0 -83.17 175.04 10.26 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.097 -0.956 . . . . 1.09 110.052 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.437 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 4.5 m-85 -46.17 -53.69 21.25 Favored Pre-proline 0 CA--C 1.544 0.725 0 N-CA-C 112.915 0.709 . . . . 2.05 112.915 -178.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.437 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 19.7 Cg_endo -59.14 -38.56 85.84 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 122.138 1.892 . . . . 0.85 112.866 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.634 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 27.0 mt-10 -66.53 -40.38 89.1 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.187 0.518 . . . . 0.66 110.257 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -63.38 -36.33 83.35 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.45 -0.795 . . . . 0.91 110.903 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.5 mt -62.34 -23.37 66.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.181 -0.463 . . . . 1.23 111.693 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.11 -40.42 9.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.192 0.52 . . . . 1.14 110.508 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.568 ' HE2' ' HA ' ' B' ' 289' ' ' ALA . 10.9 tpt -54.84 -48.83 72.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.264 -0.88 . . . . 1.24 111.803 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.413 ' SD ' ' HG3' ' A' ' 71' ' ' MET . 0.1 OUTLIER -89.8 22.93 2.9 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 122.241 -0.287 . . . . 0.99 111.77 -179.442 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.09 -41.81 1.11 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.298 0.571 . . . . 1.21 111.454 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -86.48 84.18 7.48 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.016 -0.538 . . . . 2.96 110.829 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.7 pttt -93.22 161.86 14.24 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.69 -0.485 . . . . 3.81 109.69 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.9 tpp -86.91 143.43 27.41 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.724 0.297 . . . . 3.21 110.777 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -79.03 65.88 4.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.268 0.556 . . . . 2.74 110.974 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -111.96 174.22 5.98 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.912 -0.585 . . . . 2.35 109.866 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.69 45.57 1.3 Allowed 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.533 0.683 . . . . 3.53 110.577 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 . . . . . 0 C--O 1.251 1.149 0 CA-C-N 115.107 -0.952 . . . . 3.21 110.391 -179.932 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . 0.664 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 1.4 tpm_? . . . . . 0 N--CA 1.479 0.978 0 N-CA-C 110.564 -0.162 . . . . 3.73 110.564 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . 0.664 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -58.44 -30.91 67.28 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 120.801 0.334 . . . . 1.26 111.39 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . 0.704 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -70.44 -12.21 61.42 Favored 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 116.05 -0.523 . . . . 1.22 111.316 -178.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . 0.453 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 14.8 m120 -99.87 -40.86 7.48 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-O 121.76 0.791 . . . . 0.96 110.033 173.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . 0.583 ' O ' ' HB2' ' B' ' 294' ' ' SER . 5.7 mt -66.38 -44.54 82.85 Favored 'General case' 0 C--O 1.206 -1.211 0 CA-C-N 114.77 -1.105 . . . . 1.85 109.42 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.791 ' CZ2' HG21 ' A' ' 27' ' ' ILE . 10.3 m0 -56.29 -53.92 58.56 Favored Pre-proline 0 N--CA 1.467 0.411 0 N-CA-C 109.519 -0.549 . . . . 0.54 109.519 177.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.704 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 13.1 Cg_exo -47.79 -31.56 15.24 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 122.673 2.248 . . . . 0.58 112.951 175.205 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.583 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 6.0 m -58.05 -65.0 2.11 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-O 118.459 -0.781 . . . . 1.39 110.847 178.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.555 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 86.9 Cg_exo -52.56 -33.75 59.65 Favored 'Trans proline' 0 C--N 1.369 1.65 0 C-N-CA 121.62 1.547 . . . . 0.6 112.884 176.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 10.7 tp -67.09 -38.79 86.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.234 0.54 . . . . 1.08 109.609 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 24.8 ttt -67.47 -38.93 85.15 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.715 -0.846 . . . . 2.31 108.715 178.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . 0.459 HG12 ' O ' ' B' ' 294' ' ' SER . 18.3 mm -66.91 -36.2 76.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.021 -0.991 . . . . 1.13 108.689 177.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . 0.474 ' HZ2' ' HB3' ' A' ' 14' ' ' GLU . 0.1 OUTLIER -63.75 -35.75 81.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.698 -0.683 . . . . 1.11 109.419 178.199 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 2.4 mmt180 -68.12 -38.4 82.18 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.855 -0.611 . . . . 2.87 109.583 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 28.6 m -69.62 -33.74 73.09 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.54 -0.754 . . . . 0.91 110.401 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -77.11 -32.83 56.83 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.292 -0.632 . . . . 2.89 109.292 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.5 -33.2 74.61 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.705 -0.68 . . . . 1.29 109.202 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -77.88 -35.96 50.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.254 -0.885 . . . . 1.36 109.941 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.5 t . . . . . 0 C--O 1.252 1.201 0 CA-C-O 118.108 -0.949 . . . . 1.39 110.301 179.662 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' ' CA' . . . . . 0.653 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' ' CA' . . . . . 0.634 'CA ' ' OE1' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 110.003 -0.369 . . . . 2.97 110.003 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -82.78 62.1 6.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.287 0.565 . . . . 3.47 111.091 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.28 -39.02 25.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.722 -0.672 . . . . 3.53 110.227 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.1 mt -84.47 60.71 6.2 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.021 -0.536 . . . . 2.32 110.909 -179.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.27 -79.52 0.16 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.515 -0.766 . . . . 1.92 110.772 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.45 ' CD ' ' HZ1' ' A' ' 13' ' ' LYS . 2.2 mm-40 49.26 61.34 3.19 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.977 -0.556 . . . . 1.44 111.213 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.14 -44.68 1.15 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.676 -0.693 . . . . 1.4 109.631 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -87.24 -37.55 17.14 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.69 -0.856 . . . . 1.75 108.69 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.451 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 2.8 mt -58.97 -31.86 46.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.149 -0.932 . . . . 1.55 111.143 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.26 -37.81 88.69 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.371 -0.603 . . . . 1.26 109.371 178.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.44 ' CD ' ' HZ2' ' B' ' 299' ' ' LYS . 1.2 tm-20 -71.76 -32.31 67.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.308 -0.86 . . . . 1.18 110.315 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.1 m-30 -70.93 -37.27 72.88 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.068 -0.514 . . . . 1.8 110.45 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 82.6 mttt -64.71 -32.99 74.92 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 121.61 0.719 . . . . 1.39 110.046 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.485 ' HA ' ' OE1' ' A' ' 14' ' ' GLU . 1.4 tp10 -59.64 -32.28 70.29 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.459 -0.791 . . . . 1.29 110.639 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.31 -45.76 86.53 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.147 -0.479 . . . . 0.85 110.738 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -82.1 12.23 4.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.799 0.333 . . . . 1.25 111.808 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.8 m -123.05 -44.27 2.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.365 -0.38 . . . . 0.94 111.019 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.463 ' HB2' ' CG ' ' B' ' 299' ' ' LYS . 92.4 mt -88.98 -31.85 17.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.826 0.346 . . . . 0.89 111.456 -179.329 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -77.54 -56.34 4.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.882 0.372 . . . . 1.03 110.43 -179.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.638 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 19.8 t70 -86.02 140.17 30.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.812 -0.631 . . . . 0.59 110.751 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.3 mptt -119.22 -0.17 11.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.923 -0.581 . . . . 2.09 111.305 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.635 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 9.7 m-20 -86.95 -45.07 11.14 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.087 0.47 . . . . 0.82 110.031 -179.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 119.26 -6.66 12.9 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 110.586 -1.006 . . . . 0.87 110.586 -178.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -61.52 -33.52 73.96 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 114.642 -0.779 . . . . 0.74 109.966 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.66 41.97 97.49 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.008 -0.615 . . . . 1.3 112.77 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.408 HG21 ' HA ' ' A' ' 64' ' ' ASP . 1.0 OUTLIER -141.9 145.85 35.07 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.811 -0.194 . . . . 1.11 110.517 179.79 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.606 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 89.9 mt -84.68 106.47 14.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.076 0.465 . . . . 0.76 110.355 178.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.09 178.11 4.75 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.869 -0.605 . . . . 1.12 109.651 179.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.52 -35.22 67.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.01 0.433 . . . . 1.08 111.086 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -58.91 -49.08 79.15 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.943 -0.571 . . . . 0.77 112.168 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.653 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 54.8 mp0 -81.01 -26.01 36.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.257 0.551 . . . . 0.87 111.335 -178.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.493 HD23 ' HE3' ' A' ' 51' ' ' MET . 20.1 tp -72.35 -32.85 66.83 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.387 -0.824 . . . . 1.12 110.213 -179.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -86.74 -33.37 13.06 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.87 -0.681 . . . . 0.36 113.825 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.88 -40.03 79.28 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 112.41 0.522 . . . . 0.54 112.41 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.5 p -70.51 -50.71 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 O-C-N 122.17 -0.331 . . . . 1.97 110.636 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.0 mtt -56.26 -43.74 79.04 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.065 0.46 . . . . 1.24 111.264 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -53.99 -42.01 68.56 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.373 -0.83 . . . . 2.37 111.872 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.8 m -84.17 -18.72 35.74 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.071 -0.513 . . . . 0.99 111.77 -178.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.6 mp -87.85 -53.16 4.9 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 111.894 0.331 . . . . 1.21 111.894 -178.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -150.55 43.19 0.73 Allowed Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.471 -0.871 . . . . 0.56 112.154 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 71.32 155.45 0.15 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.604 0.716 . . . . 3.6 111.344 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -95.61 134.19 24.57 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.728 -0.669 . . . . 0.96 109.91 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.25 -160.46 0.11 Allowed 'Trans proline' 0 C--O 1.23 0.116 0 C-N-CA 122.824 2.35 . . . . 0.72 111.301 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.1 p -83.63 165.17 19.21 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 109.689 -0.486 . . . . 1.09 109.689 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -64.91 -24.13 67.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 2.13 110.199 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.24 -50.87 62.29 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.313 -0.403 . . . . 0.8 110.859 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -68.11 -33.72 75.05 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.317 0.58 . . . . 0.81 110.199 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.5 tp -68.3 -41.36 81.04 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.732 -0.667 . . . . 0.94 111.424 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.525 ' O ' HG23 ' A' ' 52' ' ' ILE . 23.4 tt0 -67.64 -40.78 84.56 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.876 -0.602 . . . . 1.31 110.792 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -72.6 -27.07 61.94 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.576 -0.45 . . . . 1.42 110.706 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.493 ' HE3' HD23 ' A' ' 32' ' ' LEU . 1.1 tmm? -62.91 -38.58 91.53 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.494 -0.321 . . . . 0.78 110.48 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.525 HG23 ' O ' ' A' ' 49' ' ' GLN . 10.3 tp -78.76 -15.82 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 CA-C-O 121.368 0.604 . . . . 1.05 110.062 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -83.98 -27.88 28.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.827 0.822 . . . . 1.4 108.872 178.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.424 ' CD ' ' HG3' ' B' ' 287' ' ' ARG . 0.9 OUTLIER -81.54 14.79 2.36 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.977 -1.01 . . . . 1.58 111.0 -179.629 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.863 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 1.4 p -144.24 -41.16 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 116.477 -0.328 . . . . 1.37 111.253 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.642 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 21.5 t70 -77.94 92.19 4.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.653 0.739 . . . . 0.7 110.827 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.53 -29.29 68.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.082 -0.963 . . . . 1.17 112.283 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.96 -39.71 87.32 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 121.053 -0.259 . . . . 0.85 110.484 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 95.12 46.99 2.71 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.953 -0.642 . . . . 1.03 113.249 178.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -137.47 -0.76 2.15 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.432 0.634 . . . . 2.17 110.233 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.89 15.5 69.26 Favored Glycine 0 C--N 1.334 0.459 0 CA-C-N 115.57 -0.741 . . . . 0.73 113.191 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.8 m -134.05 133.82 41.63 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 121.377 0.608 . . . . 0.9 111.373 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.561 HD11 ' CH2' ' B' ' 292' ' ' TRP . 0.3 OUTLIER -121.19 118.6 56.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.966 -0.561 . . . . 0.95 109.763 178.974 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.408 ' HA ' HG21 ' A' ' 26' ' ' THR . 3.2 t70 -99.06 -172.59 2.31 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 123.743 0.652 . . . . 1.09 109.749 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.482 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 0.4 OUTLIER -51.75 -55.32 31.01 Favored Pre-proline 0 N--CA 1.469 0.494 0 CA-C-O 119.088 -0.482 . . . . 2.05 112.121 -179.659 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.482 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 6.0 Cg_endo -49.07 -44.61 32.31 Favored 'Trans proline' 0 C--N 1.354 0.816 0 C-N-CA 122.456 2.104 . . . . 0.85 112.48 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.642 ' OE2' 'CA ' ' A' ' 182' ' ' ' CA' . 21.4 mt-10 -69.34 -47.16 65.2 Favored 'General case' 0 C--O 1.222 -0.348 0 O-C-N 123.881 0.738 . . . . 0.66 110.51 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -59.03 -40.48 85.16 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.049 0.452 . . . . 0.91 111.462 -178.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 97.7 mt -57.23 -35.06 69.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.629 -0.714 . . . . 1.23 111.272 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -87.24 -37.82 16.9 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.279 -0.419 . . . . 1.14 110.903 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.509 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 11.1 tpt -59.1 -46.97 86.95 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.905 -0.589 . . . . 1.24 111.639 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.69 29.43 1.16 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.666 -0.243 . . . . 0.99 111.267 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -136.46 -49.63 0.66 Allowed 'General case' 0 C--O 1.237 0.415 0 CA-C-O 120.842 0.353 . . . . 1.21 110.357 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.42 90.11 3.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.064 -0.516 . . . . 2.96 109.842 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -99.86 158.05 16.08 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.171 -0.468 . . . . 3.81 110.592 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -81.15 162.63 23.57 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.264 -0.425 . . . . 3.21 110.855 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.7 mttm -98.21 -6.39 31.36 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.192 -0.458 . . . . 2.74 111.922 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -82.82 -175.54 5.85 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.608 -0.515 . . . . 2.35 109.608 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.7 m -95.0 130.15 41.78 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.654 -0.248 . . . . 3.53 110.478 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.447 ' HB2' ' ND2' ' B' ' 290' ' ' ASN . 1.4 p-10 . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.02 -0.99 . . . . 3.21 110.221 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . 0.424 ' HG3' ' CD ' ' A' ' 54' ' ' GLU . 8.4 ttt-85 . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 109.353 -0.61 . . . . 3.73 109.353 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . 0.481 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -59.88 -23.77 63.72 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.049 0.452 . . . . 1.26 111.559 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . 0.689 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -67.43 -11.81 58.71 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-O 119.02 -0.514 . . . . 1.22 109.655 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . 0.447 ' ND2' ' HB2' ' A' ' 80' ' ' ASP . 5.7 m120 -99.9 -35.32 9.79 Favored 'General case' 0 C--O 1.246 0.915 0 CA-C-O 121.473 0.654 . . . . 0.96 111.086 174.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . 0.497 ' O ' ' HG2' ' B' ' 295' ' ' PRO . 7.1 mp -79.73 -8.08 59.02 Favored 'General case' 0 C--O 1.213 -0.868 0 C-N-CA 123.878 0.871 . . . . 1.85 110.416 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.863 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 6.1 m0 -92.45 -55.1 0.25 Allowed Pre-proline 0 C--N 1.318 -0.792 0 N-CA-C 108.062 -1.088 . . . . 0.54 108.062 174.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.689 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 9.8 Cg_exo -48.51 -38.63 35.92 Favored 'Trans proline' 0 C--N 1.36 1.133 0 C-N-CA 123.337 2.691 . . . . 0.58 112.707 175.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.467 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 5.6 t -61.53 -62.58 5.62 Favored Pre-proline 0 CA--C 1.546 0.817 0 N-CA-C 108.616 -0.883 . . . . 1.39 108.616 178.108 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.497 ' HG2' ' O ' ' B' ' 291' ' ' LEU . 1.0 OUTLIER -46.25 -40.18 21.67 Favored 'Trans proline' 0 C--N 1.361 1.192 0 C-N-CA 123.156 2.571 . . . . 0.6 113.343 174.745 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 13.5 tp -68.86 -37.39 79.07 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.049 0.452 . . . . 1.08 109.968 178.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 27.2 ttt -63.61 -37.6 87.95 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.614 -0.884 . . . . 2.31 108.614 178.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 34.3 mm -62.75 -41.21 91.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.113 -0.949 . . . . 1.13 109.073 177.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . 0.463 ' CG ' ' HB2' ' A' ' 18' ' ' LEU . 0.2 OUTLIER -62.45 -43.75 98.06 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.452 -0.795 . . . . 1.11 109.753 179.182 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -64.06 -33.98 76.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.295 0.569 . . . . 2.87 110.419 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 39.5 m -69.98 -34.72 73.73 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.621 -0.718 . . . . 0.91 109.245 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -75.98 -28.61 57.93 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 109.423 -0.584 . . . . 2.89 109.423 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -69.97 -35.42 74.45 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.691 -0.855 . . . . 1.29 108.691 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -76.14 -40.02 53.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.189 -0.914 . . . . 1.36 109.104 178.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 6.9 m . . . . . 0 C--O 1.247 0.935 0 CA-C-N 114.848 -1.069 . . . . 1.39 111.763 178.692 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' ' CA' . . . . . 0.653 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' ' CA' . . . . . 0.642 'CA ' ' OD1' ' A' ' 56' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.802 0 CA-C-O 120.897 0.38 . . . . 2.97 110.179 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -73.09 90.74 1.55 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.383 0.611 . . . . 3.47 110.23 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -147.58 -51.57 0.19 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.43 -0.804 . . . . 3.53 109.091 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 33.2 mt -96.39 37.54 1.26 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.369 -0.832 . . . . 2.32 109.853 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -68.23 0.54 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.556 -0.747 . . . . 1.92 110.906 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 43.65 67.66 0.63 Allowed 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.137 0.898 . . . . 1.44 111.593 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.83 -44.5 2.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 1.4 111.484 -179.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -89.55 -34.05 16.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.075 0.464 . . . . 1.75 110.391 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 26.7 mt -62.57 -25.5 38.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.81 -0.632 . . . . 1.55 110.018 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.63 91.94 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.395 0.617 . . . . 1.26 111.103 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -83.72 -18.36 38.16 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.904 -0.589 . . . . 1.18 110.518 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 18.6 m-30 -75.94 -40.31 54.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.698 -0.683 . . . . 1.8 109.3 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -64.79 -26.48 68.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.211 -0.904 . . . . 1.39 109.969 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.431 ' HG2' ' HE3' ' B' ' 299' ' ' LYS . 1.8 tp10 -67.37 -23.85 65.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.456 -0.793 . . . . 1.29 110.171 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.647 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -74.35 -37.54 63.49 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 109.793 -0.447 . . . . 0.85 109.793 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -75.26 -2.02 26.14 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.557 -0.457 . . . . 1.25 110.512 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -112.6 -53.56 2.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.965 0.412 . . . . 0.94 111.474 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.1 mt -85.76 -42.34 14.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.243 -0.435 . . . . 0.89 111.7 -179.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.647 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 82.6 t80 -75.06 -35.31 61.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.304 -0.407 . . . . 1.03 111.259 -177.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.635 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 39.0 t70 -91.96 130.58 37.68 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.844 -0.428 . . . . 0.59 109.844 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.416 ' HZ2' HG23 ' A' ' 35' ' ' VAL . 6.1 mptt -106.14 -9.65 16.84 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.439 0.533 . . . . 2.09 112.439 -178.145 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.643 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 0.0 OUTLIER -91.67 -35.56 14.13 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 111.688 0.255 . . . . 0.82 111.688 -178.076 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.06 0.76 33.75 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 121.184 -0.531 . . . . 0.87 111.815 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -81.33 -27.98 34.73 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.812 0.339 . . . . 0.74 110.576 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.06 -46.07 3.59 Favored Glycine 0 CA--C 1.518 0.249 0 C-N-CA 121.318 -0.468 . . . . 1.3 113.475 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -53.27 123.72 12.65 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.522 0.564 . . . . 1.11 112.522 -179.045 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.647 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 18.0 mt -69.83 119.28 15.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-N 116.254 -0.43 . . . . 0.76 111.32 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.408 HG21 ' H ' ' A' ' 29' ' ' THR . 0.8 OUTLIER -127.26 168.66 14.44 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 108.9 -0.778 . . . . 1.12 108.9 178.485 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.408 ' H ' HG21 ' A' ' 28' ' ' THR . 0.1 OUTLIER -55.78 -33.78 64.68 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.817 0.341 . . . . 1.08 111.709 -179.894 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -60.47 -45.44 93.72 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.353 0.501 . . . . 0.77 112.353 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.662 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 19.4 mp0 -80.37 -23.21 40.62 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-O 121.216 0.531 . . . . 0.87 111.688 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.406 HD13 ' CD1' ' B' ' 292' ' ' TRP . 16.0 tp -72.06 -50.74 25.86 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.851 -0.613 . . . . 1.12 110.167 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.09 -36.13 79.8 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.787 -0.642 . . . . 0.36 113.939 -179.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -55.7 -32.71 63.54 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 117.677 0.738 . . . . 0.54 112.385 -178.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.416 HG23 ' HZ2' ' A' ' 21' ' ' LYS . 99.0 t -77.53 -51.61 17.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.233 -0.587 . . . . 1.97 109.955 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 52.6 mtt -59.0 -32.81 70.02 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.924 -0.58 . . . . 1.24 111.841 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.1 ttt180 -58.43 -40.45 82.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.45 -0.341 . . . . 2.37 111.789 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.1 m -97.29 -6.65 33.92 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.112 0.482 . . . . 0.99 110.645 -178.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 16.2 tp -87.06 -47.74 8.67 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.911 -0.586 . . . . 1.21 110.167 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -161.48 47.47 0.37 Allowed Glycine 0 C--N 1.335 0.479 0 C-N-CA 120.45 -0.881 . . . . 0.56 112.634 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 69.98 140.23 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.508 0.671 . . . . 3.6 111.476 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -99.36 136.51 20.4 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.029 -0.532 . . . . 0.96 110.587 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.61 -163.74 0.22 Allowed 'Trans proline' 0 C--O 1.24 0.575 0 C-N-CA 122.898 2.398 . . . . 0.72 112.063 179.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 73.0 p -73.64 163.9 27.38 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.355 -0.609 . . . . 1.09 109.355 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -68.18 -29.13 67.92 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.914 0.387 . . . . 2.13 110.181 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.37 -49.76 72.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.946 -0.57 . . . . 0.8 110.422 178.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -63.54 -35.42 80.44 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.909 -0.587 . . . . 0.81 110.644 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.0 tp -70.07 -34.55 73.33 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.949 -0.569 . . . . 0.94 110.182 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.503 ' O ' HG22 ' A' ' 52' ' ' ILE . 15.8 tt0 -68.11 -39.91 82.67 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.545 -0.539 . . . . 1.31 109.545 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -61.02 -29.84 69.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.557 0.694 . . . . 1.42 109.722 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.0 mmm -65.43 -43.27 90.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.353 -0.84 . . . . 0.78 111.946 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.503 HG22 ' O ' ' A' ' 49' ' ' GLN . 4.8 tp -71.73 -18.33 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 CA-C-O 120.985 0.422 . . . . 1.05 111.355 -178.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -81.06 -25.02 37.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.625 0.726 . . . . 1.4 110.577 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.414 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 13.1 tt0 -93.51 8.26 41.35 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.325 -0.852 . . . . 1.58 111.046 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.752 ' HB ' ' CB ' ' B' ' 288' ' ' ALA . 8.5 p -142.85 25.86 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.806 0.812 . . . . 1.37 112.701 -177.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.635 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 30.5 t70 -146.65 95.53 2.61 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.683 0.754 . . . . 0.7 109.709 178.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.24 -29.98 70.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.334 -0.848 . . . . 1.17 112.047 -178.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.48 -16.02 62.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.998 0.428 . . . . 0.85 111.068 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.77 41.73 95.56 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 121.147 -0.549 . . . . 1.03 113.669 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -120.7 -19.96 7.21 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.955 0.407 . . . . 2.17 110.587 179.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.419 ' C ' ' HG1' ' A' ' 62' ' ' THR . . . 86.12 27.89 29.76 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 115.89 -0.595 . . . . 0.73 112.578 179.058 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.419 ' HG1' ' C ' ' A' ' 61' ' ' GLY . 16.3 m -154.78 142.88 20.24 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 121.365 0.602 . . . . 0.9 110.963 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.539 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 1.4 mt -123.35 113.71 38.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.696 -0.684 . . . . 0.95 109.787 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -87.06 -171.0 3.3 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.455 -0.793 . . . . 1.09 110.285 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.497 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 3.9 m-85 -58.48 -53.4 66.53 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 116.004 -0.544 . . . . 2.05 111.536 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.6 Cg_endo -55.17 -38.69 93.44 Favored 'Trans proline' 0 C--N 1.361 1.214 0 C-N-CA 122.274 1.982 . . . . 0.85 112.85 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.65 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 38.2 mt-10 -68.38 -44.94 74.05 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.222 0.534 . . . . 0.66 111.154 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -58.2 -29.77 65.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.235 -0.893 . . . . 0.91 112.135 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 80.4 mt -61.82 -27.3 68.67 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-N 116.41 -0.359 . . . . 1.23 111.427 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -106.62 -26.92 11.15 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.894 -0.322 . . . . 1.14 111.215 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.599 ' HG3' ' SD ' ' A' ' 72' ' ' MET . 10.5 tpt -49.82 -52.02 35.42 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.298 0.481 . . . . 1.24 112.298 -179.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.599 ' SD ' ' HG3' ' A' ' 71' ' ' MET . 0.3 OUTLIER -94.04 17.65 12.04 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.274 0.472 . . . . 0.99 112.274 -178.83 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -110.39 -41.57 4.34 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.885 0.374 . . . . 1.21 111.21 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -93.9 85.65 4.84 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.917 -0.401 . . . . 2.96 109.917 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -102.64 179.26 4.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.952 0.406 . . . . 3.81 111.488 -179.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 71.7 mtp -82.22 172.96 12.55 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.184 0.516 . . . . 3.21 111.071 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -102.69 -28.57 12.04 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.135 -0.484 . . . . 2.74 110.467 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -63.63 143.62 57.68 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.164 -0.471 . . . . 2.35 110.881 -179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.6 m -70.01 119.73 14.66 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.999 -0.546 . . . . 3.53 111.088 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.254 1.32 0 CA-C-O 118.448 -0.787 . . . . 3.21 109.874 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' B' ' 287' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 110.02 -0.363 . . . . 3.73 110.02 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . 0.752 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -58.58 -24.15 60.23 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-O 120.99 0.424 . . . . 1.26 110.517 178.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . 0.565 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -68.97 -14.54 63.1 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 115.733 -0.667 . . . . 1.22 111.002 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . 0.409 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 6.5 m120 -96.14 -39.88 9.48 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 109.092 -0.707 . . . . 0.96 109.092 175.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . 0.752 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 1.2 mp -64.53 -42.54 95.69 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 115.212 -0.903 . . . . 1.85 109.385 178.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.647 ' CZ2' HG21 ' A' ' 27' ' ' ILE . 4.4 m0 -56.56 -57.28 24.49 Favored Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 108.307 -0.998 . . . . 0.54 108.307 177.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.565 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 7.0 Cg_exo -50.06 -24.71 11.41 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.844 2.362 . . . . 0.58 113.759 175.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.506 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 50.6 m -60.44 -68.39 0.79 Allowed Pre-proline 0 CA--C 1.544 0.715 0 CA-C-O 118.484 -0.769 . . . . 1.39 109.585 178.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.752 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 69.6 Cg_exo -48.88 -38.32 38.09 Favored 'Trans proline' 0 C--N 1.371 1.72 0 C-N-CA 121.88 1.72 . . . . 0.6 112.629 175.094 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . 0.498 ' O ' ' HG3' ' B' ' 300' ' ' ARG . 19.6 tp -61.39 -37.93 85.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.161 -0.472 . . . . 1.08 110.011 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 6.2 ttt -67.16 -39.69 86.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.818 -0.628 . . . . 2.31 109.46 178.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 43.6 mm -64.73 -39.63 86.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.646 0.736 . . . . 1.13 109.057 178.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . 0.515 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.1 OUTLIER -62.68 -40.84 98.36 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.905 -1.043 . . . . 1.11 109.119 178.011 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . 0.498 ' HG3' ' O ' ' B' ' 296' ' ' LEU . 30.3 mtp180 -63.29 -44.79 94.05 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.734 -0.666 . . . . 2.87 109.898 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 50.7 m -59.95 -37.83 80.69 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.71 -0.677 . . . . 0.91 110.109 178.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.2 tptp -73.25 -38.31 66.03 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 110.09 -0.337 . . . . 2.89 110.09 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -64.83 -28.48 69.58 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.603 0.716 . . . . 1.29 109.638 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -81.46 -30.99 33.2 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.142 -0.935 . . . . 1.36 109.636 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 13.0 m . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.304 -0.855 . . . . 1.39 112.294 179.112 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' ' CA' . . . . . 0.662 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' ' CA' . . . . . 0.65 'CA ' ' OE1' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.483 ' HB3' ' OE1' ' A' ' 3' ' ' GLN . . . . . . . . 0 N--CA 1.486 1.353 0 N-CA-C 110.006 -0.368 . . . . 2.97 110.006 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -79.02 86.41 4.88 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-O 121.33 0.586 . . . . 3.47 109.879 178.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.483 ' OE1' ' HB3' ' A' ' 1' ' ' ALA . 6.1 mp0 -124.97 -65.62 1.02 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.564 -0.744 . . . . 3.53 109.29 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 mt -105.73 67.34 0.75 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.66 -0.7 . . . . 2.32 110.117 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.8 -76.65 0.16 Allowed 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.22 -0.9 . . . . 1.92 109.686 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 38.13 69.26 0.26 Allowed 'General case' 0 CA--C 1.532 0.251 0 O-C-N 124.306 1.004 . . . . 1.44 112.658 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.88 -56.37 1.19 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.944 -0.571 . . . . 1.4 110.699 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -79.5 -41.67 26.92 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.232 -0.655 . . . . 1.75 109.232 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 5.7 mt -57.45 -24.7 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 114.785 -1.098 . . . . 1.55 111.926 -179.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.07 -31.44 72.66 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 120.791 0.329 . . . . 1.26 111.58 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.91 -21.58 29.62 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.04 0.448 . . . . 1.18 110.475 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -76.51 -32.08 58.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.98 -0.555 . . . . 1.8 110.032 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -72.09 -15.45 62.01 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.171 0.51 . . . . 1.39 110.679 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -72.45 -26.05 61.68 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.907 -0.588 . . . . 1.29 110.386 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.565 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -66.73 -43.09 85.12 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.163 -0.471 . . . . 0.85 110.78 -178.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -80.65 5.32 15.89 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.367 -0.379 . . . . 1.25 110.871 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.3 m -112.74 -41.28 3.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.94 112.075 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.499 ' HB2' ' HG3' ' B' ' 299' ' ' LYS . 18.2 mt -103.49 -44.15 5.2 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.438 0.532 . . . . 0.89 112.438 -178.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.565 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 83.1 t80 -62.59 -34.23 76.58 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.247 0.546 . . . . 1.03 110.435 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.652 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 35.0 t70 -93.95 138.63 31.86 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.688 -0.687 . . . . 0.59 110.139 178.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -124.52 32.62 5.43 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.257 -0.277 . . . . 2.09 110.989 -179.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.622 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 0.1 OUTLIER -131.61 -31.14 1.59 Allowed 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.641 -0.424 . . . . 0.82 111.195 -179.207 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.73 18.65 17.6 Favored Glycine 0 CA--C 1.505 -0.562 0 N-CA-C 111.045 -0.822 . . . . 0.87 111.045 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -97.36 -32.17 12.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.294 -0.453 . . . . 0.74 110.596 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 69.13 31.6 72.2 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 120.922 -0.656 . . . . 1.3 113.707 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.82 138.07 53.29 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 117.909 0.854 . . . . 1.11 110.675 179.17 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.6 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 28.6 mt -81.8 111.46 18.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-O 121.089 0.471 . . . . 0.76 111.219 -178.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -128.11 170.18 13.23 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.353 -0.84 . . . . 1.12 109.319 178.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.84 -31.74 59.8 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.18 0.514 . . . . 1.08 112.217 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.2 tttt -62.11 -45.53 93.06 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.273 0.559 . . . . 0.77 112.212 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.665 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 39.5 mp0 -79.22 -20.95 47.0 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.896 -0.593 . . . . 0.87 111.162 -178.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 23.5 tp -80.0 -47.39 15.01 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.428 -0.806 . . . . 1.12 110.602 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.14 -37.12 72.34 Favored Glycine 0 CA--C 1.512 -0.145 0 CA-C-N 115.429 -0.805 . . . . 0.36 113.289 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 p -57.12 -28.1 62.39 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.983 0.392 . . . . 0.54 111.89 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 93.5 t -77.07 -56.28 8.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 120.881 -0.328 . . . . 1.97 110.616 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 51.3 mtt -57.69 -37.72 73.95 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.447 -0.342 . . . . 1.24 110.872 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -55.12 -42.18 72.64 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.755 -0.657 . . . . 2.37 111.366 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.8 m -89.58 -19.48 24.92 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.842 0.354 . . . . 0.99 111.786 -178.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.3 tp -79.9 -36.87 35.82 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 112.14 0.422 . . . . 1.21 112.14 -179.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.13 43.81 0.14 Allowed Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.702 -0.761 . . . . 0.56 112.454 -178.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 70.85 147.49 0.07 Allowed 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.77 0.795 . . . . 3.6 111.936 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -102.64 134.8 19.69 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.644 -0.707 . . . . 0.96 109.819 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.7 -161.2 0.11 Allowed 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.475 2.117 . . . . 0.72 112.514 179.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.5 p -76.43 162.16 28.08 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.535 -0.302 . . . . 1.09 110.319 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -61.92 -31.03 71.31 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 116.676 -0.238 . . . . 2.13 111.199 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.72 -49.21 77.37 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.144 0.497 . . . . 0.8 110.312 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -66.52 -35.12 79.47 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.054 -0.521 . . . . 0.81 110.877 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 21.2 tp -71.61 -34.54 69.94 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.642 -0.708 . . . . 0.94 111.217 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -71.55 -39.28 70.78 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.697 -0.483 . . . . 1.31 109.697 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -60.04 -32.38 70.85 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.562 -0.745 . . . . 1.42 109.909 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.404 ' SD ' ' HA ' ' B' ' 288' ' ' ALA . 1.8 mmm -62.22 -45.98 90.94 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.196 -0.911 . . . . 0.78 110.66 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.1 tp -75.98 -18.49 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 C-N-CA 120.71 -0.396 . . . . 1.05 111.41 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -78.96 -20.09 50.05 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.298 0.571 . . . . 1.4 110.269 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.49 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 14.4 tt0 -99.08 9.5 43.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.564 -0.744 . . . . 1.58 111.706 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.755 ' HB ' ' CB ' ' B' ' 288' ' ' ALA . 9.5 p -137.6 -13.07 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-O 121.227 0.537 . . . . 1.37 112.34 -176.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.604 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 26.9 t70 -109.49 98.48 7.86 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.74 -0.837 . . . . 0.7 108.74 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.0 -22.18 61.46 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 115.957 -0.565 . . . . 1.17 111.936 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.42 -24.28 57.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.155 0.502 . . . . 0.85 110.529 178.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 75.8 29.04 59.87 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.926 -0.654 . . . . 1.03 113.219 178.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -108.05 -22.17 12.51 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.137 -0.69 . . . . 2.17 109.137 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.99 -2.71 64.14 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.846 -0.693 . . . . 0.73 113.526 178.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.3 m -128.13 153.51 46.78 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-O 121.289 0.566 . . . . 0.9 111.526 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.608 HD11 ' CH2' ' B' ' 292' ' ' TRP . 0.5 OUTLIER -132.57 122.76 48.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.628 -0.715 . . . . 0.95 110.317 179.515 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -96.11 -171.17 2.26 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 123.709 0.631 . . . . 1.09 110.503 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.51 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 4.8 m-85 -54.18 -55.09 40.39 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 123.801 0.84 . . . . 2.05 111.422 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 10.1 Cg_endo -53.33 -42.68 63.45 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 122.937 2.425 . . . . 0.85 111.845 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.615 ' OE2' 'CA ' ' A' ' 182' ' ' ' CA' . 23.5 mt-10 -65.47 -48.94 70.95 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.216 -0.902 . . . . 0.66 109.68 178.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -56.67 -43.93 80.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.316 0.579 . . . . 0.91 110.367 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.4 mt -55.56 -31.86 62.52 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.177 -0.92 . . . . 1.23 111.72 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.3 m -94.61 -38.28 10.93 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.921 0.391 . . . . 1.14 111.263 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.482 ' HE3' ' HA ' ' B' ' 289' ' ' ALA . 12.4 tpt -61.26 -59.24 5.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.992 -0.549 . . . . 1.24 111.937 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -77.93 31.98 0.17 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.4 -0.364 . . . . 0.99 111.437 -179.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.45 ' H ' ' C ' ' A' ' 71' ' ' MET . . . -136.69 -22.32 1.25 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.171 -0.468 . . . . 1.21 111.604 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -99.89 98.29 9.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.255 0.55 . . . . 2.96 111.437 -179.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 53.1 pttt -91.52 -178.95 5.24 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.85 -0.614 . . . . 3.81 110.374 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 2.8 tpp -126.63 -174.71 3.2 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 110.123 -0.325 . . . . 3.21 110.123 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -109.6 34.1 3.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.559 0.695 . . . . 2.74 109.538 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -90.1 -167.53 1.87 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.93 -1.032 . . . . 2.35 111.164 -177.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 20.4 m -121.75 123.15 41.16 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.191 0.52 . . . . 3.53 110.623 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.776 -0.63 . . . . 3.21 110.449 -179.555 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . 0.49 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 120.906 0.384 . . . . 3.73 110.146 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . 0.755 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -57.86 -25.01 60.14 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 116.12 -0.491 . . . . 1.26 112.3 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . 0.482 ' HA ' ' HE3' ' A' ' 71' ' ' MET . . . -69.94 -1.72 10.42 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 113.24 0.83 . . . . 1.22 113.24 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . 0.467 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 7.3 m120 -112.11 -30.77 7.11 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.303 0.573 . . . . 0.96 109.477 176.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 33.0 mt -80.92 -6.02 58.17 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 114.879 -1.055 . . . . 1.85 109.809 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.608 ' CH2' HD11 ' A' ' 63' ' ' ILE . 1.7 m0 -92.13 -53.23 0.27 Allowed Pre-proline 0 CA--C 1.543 0.7 0 N-CA-C 107.589 -1.263 . . . . 0.54 107.589 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.467 ' HD2' ' C ' ' B' ' 290' ' ' ASN . 13.3 Cg_exo -51.68 -36.3 60.84 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 123.05 2.5 . . . . 0.58 112.921 175.193 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.471 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 2.7 t -58.98 -61.45 7.79 Favored Pre-proline 0 CA--C 1.548 0.885 0 CA-C-O 119.282 -0.389 . . . . 1.39 111.063 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.496 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 88.4 Cg_exo -53.12 -33.09 62.23 Favored 'Trans proline' 0 C--N 1.358 1.058 0 C-N-CA 122.691 2.261 . . . . 0.6 112.596 178.191 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 15.5 tp -68.02 -35.37 78.18 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.126 0.489 . . . . 1.08 110.091 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 16.7 ttt -70.34 -38.43 74.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.23 -0.896 . . . . 2.31 108.699 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . 0.4 HG12 ' O ' ' B' ' 294' ' ' SER . 48.9 mm -61.74 -38.37 80.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 108.211 -1.033 . . . . 1.13 108.211 177.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . 0.499 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.4 OUTLIER -59.99 -39.97 87.56 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.308 -0.627 . . . . 1.11 109.308 177.451 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -64.89 -41.15 95.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.55 -0.75 . . . . 2.87 110.414 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 19.4 m -63.45 -35.88 81.91 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.738 -0.664 . . . . 0.91 109.595 178.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 14.3 tptp -76.28 -30.21 57.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.066 -0.515 . . . . 2.89 109.736 179.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 9.4 tttp -68.71 -34.58 75.88 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.806 -0.812 . . . . 1.29 108.806 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -76.01 -40.34 53.78 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.568 -1.196 . . . . 1.36 110.08 179.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.668 -0.682 . . . . 1.39 111.455 179.575 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' ' CA' . . . . . 0.665 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' ' CA' . . . . . 0.615 'CA ' ' OE2' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.4 ' HB1' ' OE1' ' A' ' 3' ' ' GLN . . . . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 110.049 -0.352 . . . . 2.97 110.049 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -74.01 72.44 1.64 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.333 0.587 . . . . 3.47 110.85 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.4 ' OE1' ' HB1' ' A' ' 1' ' ' ALA . 2.2 mp0 -106.6 -43.84 4.63 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.518 -0.765 . . . . 3.53 110.283 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.2 mt -112.44 77.31 1.03 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.575 -0.738 . . . . 2.32 110.987 -178.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.13 -53.38 4.14 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.987 -0.551 . . . . 1.92 110.579 179.563 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.421 ' CD ' ' HZ3' ' A' ' 13' ' ' LYS . 13.4 mm-40 54.81 63.54 2.11 Favored 'General case' 0 C--O 1.224 -0.248 0 O-C-N 123.715 0.635 . . . . 1.44 111.145 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.92 -55.45 2.49 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.641 -0.424 . . . . 1.4 111.626 -178.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -94.27 -24.58 17.39 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.062 0.458 . . . . 1.75 109.953 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.426 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 6.5 mt -65.18 -23.05 32.42 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-N 115.95 -0.568 . . . . 1.55 110.581 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.61 -26.55 64.5 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.871 -0.332 . . . . 1.26 111.268 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -92.76 -12.69 30.63 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 120.866 0.365 . . . . 1.18 111.32 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -80.46 -37.54 31.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.145 0.498 . . . . 1.8 109.802 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.426 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 81.8 mttt -61.64 -22.69 65.49 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.507 0.67 . . . . 1.39 111.206 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.522 ' CG ' ' HE3' ' B' ' 299' ' ' LYS . 1.3 tp10 -70.88 -22.0 62.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.387 -0.824 . . . . 1.29 112.076 -177.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.687 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -70.18 -36.31 74.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.181 0.515 . . . . 0.85 110.647 179.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.403 ' HB3' ' HA3' ' A' ' 25' ' ' GLY . 10.5 m-85 -86.19 16.55 4.25 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.022 -0.535 . . . . 1.25 109.665 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.6 m -125.56 -56.58 1.49 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.886 -0.597 . . . . 0.94 112.202 -178.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.478 ' HB2' ' CG ' ' B' ' 299' ' ' LYS . 13.6 mt -96.1 -30.56 13.47 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.255 0.465 . . . . 0.89 112.255 -178.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.687 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 46.5 t80 -73.92 -34.03 64.2 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.062 0.458 . . . . 1.03 110.096 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.646 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 24.2 t70 -91.22 140.69 29.56 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.685 -0.689 . . . . 0.59 109.605 179.248 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -114.74 6.55 15.63 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.579 0.585 . . . . 2.09 112.579 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.639 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 0.0 OUTLIER -104.62 -53.86 2.62 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.419 -0.512 . . . . 0.82 110.942 -178.974 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 139.44 4.38 1.46 Allowed Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.827 -0.701 . . . . 0.87 112.34 -178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.93 -58.15 2.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.974 0.416 . . . . 0.74 110.017 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.403 ' HA3' ' HB3' ' A' ' 16' ' ' PHE . . . 111.84 -29.95 8.13 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.798 -0.637 . . . . 1.3 111.556 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.85 130.22 40.28 Favored 'General case' 0 C--N 1.323 -0.549 0 O-C-N 123.925 0.427 . . . . 1.11 111.859 -179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.678 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 24.1 mt -78.79 108.45 12.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 116.107 -0.497 . . . . 0.76 110.615 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.91 170.9 9.34 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 108.49 -0.93 . . . . 1.12 108.49 177.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -31.69 66.42 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 111.679 0.252 . . . . 1.08 111.679 -179.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.9 tttt -63.8 -44.96 91.76 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.066 0.395 . . . . 0.77 112.066 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.666 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 25.2 mp0 -79.97 -21.81 43.31 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 111.742 0.275 . . . . 0.87 111.742 -178.299 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.5 HD22 ' HE3' ' A' ' 51' ' ' MET . 18.1 tp -79.53 -46.62 17.01 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.083 -0.508 . . . . 1.12 110.77 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.82 -36.32 86.74 Favored Glycine 0 N--CA 1.453 -0.212 0 CA-C-N 115.851 -0.613 . . . . 0.36 113.104 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.71 -31.05 67.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.771 0.286 . . . . 0.54 111.351 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 67.0 t -73.23 -56.55 9.18 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 N-CA-C 109.265 -0.643 . . . . 1.97 109.265 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 59.9 mtt -52.15 -46.9 65.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.121 -0.945 . . . . 1.24 111.134 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -57.28 -38.02 73.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.433 -0.803 . . . . 2.37 111.3 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.0 m -95.41 14.18 23.42 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.102 -0.499 . . . . 0.99 111.671 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.8 tp -122.03 -43.1 2.35 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.536 0.208 . . . . 1.21 110.916 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -164.24 49.93 0.29 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.618 -0.801 . . . . 0.56 112.599 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 72.35 146.07 0.08 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.517 0.727 . . . . 3.6 111.707 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -87.2 140.55 32.44 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.453 -0.794 . . . . 0.96 109.88 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -77.91 -172.96 1.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.271 1.981 . . . . 0.72 111.388 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.7 p -81.76 160.33 23.63 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.935 -0.765 . . . . 1.09 108.935 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -55.16 -32.92 62.52 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.059 0.392 . . . . 2.13 112.059 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.41 -52.34 58.68 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.224 -0.444 . . . . 0.8 110.829 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -64.01 -34.03 77.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.439 . . . . 0.81 110.839 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 15.3 tp -63.73 -47.15 82.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.256 -0.429 . . . . 0.94 110.346 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -69.97 -33.39 72.02 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 116.353 -0.385 . . . . 1.31 111.459 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -71.78 -26.8 62.58 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.318 0.58 . . . . 1.42 110.157 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.5 ' HE3' HD22 ' A' ' 32' ' ' LEU . 1.8 mmm -61.95 -42.25 98.9 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.462 -0.79 . . . . 0.78 110.859 178.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.4 tp -76.87 -14.67 14.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-O 121.164 0.507 . . . . 1.05 110.278 -179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.5 t30 -78.37 -22.15 48.35 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.686 0.755 . . . . 1.4 109.054 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.617 ' OE2' ' HA ' ' B' ' 287' ' ' ARG . 2.4 tt0 -98.25 22.52 9.47 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.417 -0.811 . . . . 1.58 111.047 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.752 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 9.1 p -154.07 -36.65 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.205 0 N-CA-C 113.627 0.973 . . . . 1.37 113.627 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.629 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 28.9 t70 -89.77 91.18 8.53 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.243 -0.583 . . . . 0.7 109.524 179.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.36 -24.91 67.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.197 -0.91 . . . . 1.17 113.364 -178.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -75.58 -10.95 59.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.93 0.395 . . . . 0.85 110.66 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.08 48.59 68.98 Favored Glycine 0 CA--C 1.519 0.312 0 CA-C-N 116.077 -0.51 . . . . 1.03 114.128 178.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -128.87 -27.79 2.5 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.198 0.523 . . . . 2.17 110.027 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.73 17.88 36.97 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.78 -0.645 . . . . 0.73 113.2 178.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 2.0 m -141.75 139.99 32.98 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.886 0.343 . . . . 0.9 110.808 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.537 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.9 OUTLIER -124.56 118.92 54.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.119 0.485 . . . . 0.95 111.202 179.879 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -93.01 -167.14 1.67 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.368 -0.833 . . . . 1.09 110.472 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.47 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 28.3 m-85 -57.97 -53.32 67.0 Favored Pre-proline 0 CA--C 1.54 0.592 0 C-N-CA 122.936 0.494 . . . . 2.05 112.292 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.47 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.3 Cg_endo -57.53 -36.44 98.66 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.991 1.794 . . . . 0.85 112.026 179.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.638 ' OE2' 'CA ' ' A' ' 182' ' ' ' CA' . 31.1 mt-10 -72.14 -39.48 68.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.526 -0.761 . . . . 0.66 110.943 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -66.12 -37.47 85.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.245 -0.434 . . . . 0.91 109.835 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.438 ' O ' ' HB1' ' A' ' 73' ' ' ALA . 35.8 mt -63.71 -32.64 74.2 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.817 -0.629 . . . . 1.23 110.286 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.5 m -92.31 11.07 27.13 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.95 -0.568 . . . . 1.14 110.644 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.482 ' HE2' ' HA ' ' B' ' 289' ' ' ALA . 11.7 tpt -119.15 -68.25 0.93 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.369 -0.378 . . . . 1.24 111.181 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.523 ' HE1' ' HB3' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -69.86 -17.68 63.39 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.735 0.303 . . . . 0.99 111.727 -178.454 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.438 ' HB1' ' O ' ' A' ' 69' ' ' LEU . . . -104.06 9.47 36.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.918 0.39 . . . . 1.21 110.459 179.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -128.88 37.52 4.07 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.27 -0.423 . . . . 2.96 111.833 -178.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -67.3 157.74 33.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.075 0.464 . . . . 3.81 110.379 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 2.6 mpp? -93.33 156.03 17.05 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.118 -0.492 . . . . 3.21 111.89 -178.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 31.6 mttt -84.89 63.06 7.84 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.89 -0.595 . . . . 2.74 110.211 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -114.44 -164.75 0.95 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.427 -0.806 . . . . 2.35 109.54 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.72 90.54 5.02 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 120.975 0.417 . . . . 3.53 110.687 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.764 -0.636 . . . . 3.21 111.042 -179.878 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . 0.617 ' HA ' ' OE2' ' A' ' 54' ' ' GLU . 1.7 tpm_? . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 109.441 -0.578 . . . . 3.73 109.441 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . 0.727 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -61.4 -28.16 69.05 Favored 'General case' 0 C--O 1.214 -0.815 0 N-CA-C 113.295 0.85 . . . . 1.26 113.295 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . 0.536 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -70.59 1.3 5.36 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.03 0.752 . . . . 1.22 113.03 -179.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -115.95 -37.28 3.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 122.847 1.308 . . . . 0.96 109.431 176.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 25.6 mt -80.52 -7.14 59.09 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 113.245 -1.798 . . . . 1.85 110.662 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.752 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 5.0 m0 -93.81 -53.88 0.24 Allowed Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 107.355 -1.35 . . . . 0.54 107.355 174.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.536 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 21.5 Cg_exo -50.94 -37.11 55.58 Favored 'Trans proline' 0 C--N 1.367 1.508 0 C-N-CA 122.578 2.185 . . . . 0.58 113.029 175.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 294' ' ' SER . . . . . . . . . . . . . 1.4 t -59.67 -60.82 9.34 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-O 119.34 -0.362 . . . . 1.39 110.346 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.418 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 85.2 Cg_exo -51.14 -38.4 60.36 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 122.203 1.935 . . . . 0.6 112.091 176.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 9.5 tp -64.65 -36.73 85.21 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.824 0.345 . . . . 1.08 110.345 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 17.5 ttt -66.43 -41.66 88.87 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.499 0.666 . . . . 2.31 109.285 177.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 20.4 mm -62.93 -35.6 72.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 108.447 -0.946 . . . . 1.13 108.447 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . 0.522 ' HE3' ' CG ' ' A' ' 14' ' ' GLU . 0.2 OUTLIER -66.35 -40.86 90.08 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.88 -1.054 . . . . 1.11 109.381 178.08 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 73.1 mtt180 -63.34 -40.01 96.11 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.198 -0.455 . . . . 2.87 110.101 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 66.2 m -64.71 -42.78 95.01 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.842 -0.617 . . . . 0.91 109.782 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -69.06 -36.9 78.18 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.119 -0.491 . . . . 2.89 110.561 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 3.3 tttp -63.81 -33.08 74.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.815 0.817 . . . . 1.29 109.197 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -81.61 -21.76 38.1 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.699 -1.137 . . . . 1.36 110.81 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.251 1.161 0 CA-C-O 118.575 -0.726 . . . . 1.39 110.265 179.083 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' ' CA' . . . . . 0.666 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' ' CA' . . . . . 0.638 'CA ' ' OE2' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.183 0 N-CA-C 110.51 -0.182 . . . . 2.97 110.51 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -78.06 57.8 1.86 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.062 0.458 . . . . 3.47 111.568 -178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 -104.31 -41.52 5.75 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.559 0.695 . . . . 3.53 109.206 178.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 34.2 mt -100.8 60.95 0.97 Allowed 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 114.863 -1.062 . . . . 2.32 109.431 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.416 ' HB ' ' H ' ' A' ' 6' ' ' GLU . 1.3 m -70.76 -93.39 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.105 -0.952 . . . . 1.92 111.643 -179.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.416 ' H ' ' HB ' ' A' ' 5' ' ' THR . 50.3 mm-40 42.29 56.19 3.75 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.177 0.806 . . . . 1.44 113.177 179.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.12 -49.24 2.79 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.834 0.349 . . . . 1.4 111.188 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -104.36 -26.28 12.51 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 109.68 -0.489 . . . . 1.75 109.68 179.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mt -57.32 -27.73 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 115.491 -0.777 . . . . 1.55 110.373 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.24 -42.07 99.17 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.528 -0.76 . . . . 1.26 110.936 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -77.6 -17.27 57.97 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.168 -0.469 . . . . 1.18 111.265 -178.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -82.45 -38.4 24.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 1.8 110.445 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.411 ' HA ' ' CE2' ' A' ' 16' ' ' PHE . 38.2 mtmt -69.62 -13.9 62.55 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.372 0.606 . . . . 1.39 110.335 179.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -73.19 -17.06 61.4 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.277 -0.874 . . . . 1.29 110.696 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.624 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -69.9 -32.82 71.34 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.341 0.591 . . . . 0.85 110.377 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.411 ' CE2' ' HA ' ' A' ' 13' ' ' LYS . 12.6 m-85 -79.92 5.33 14.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.856 -0.611 . . . . 1.25 111.505 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -124.94 -47.56 1.79 Allowed 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 121.049 -0.261 . . . . 0.94 110.99 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.404 ' HB2' ' CG ' ' B' ' 299' ' ' LYS . 35.8 mt -93.22 -38.96 11.27 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 111.866 0.321 . . . . 0.89 111.866 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.624 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 92.0 t80 -74.4 -42.15 59.73 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.861 0.362 . . . . 1.03 110.898 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -87.31 136.56 32.89 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.286 -0.416 . . . . 0.59 110.671 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -106.35 -11.63 15.92 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.145 0.424 . . . . 2.09 112.145 -178.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.628 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 0.0 OUTLIER -90.87 -40.76 11.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.155 0.502 . . . . 0.82 110.655 -179.114 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.07 16.72 15.82 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 110.922 -0.871 . . . . 0.87 110.922 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.656 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 5.0 p-10 -96.86 -21.42 17.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.892 0.377 . . . . 0.74 111.02 -179.059 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.8 -46.11 3.41 Favored Glycine 0 C--O 1.227 -0.291 0 C-N-CA 121.085 -0.579 . . . . 1.3 114.269 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.39 129.84 29.64 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 117.046 0.423 . . . . 1.11 111.622 -179.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.611 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 54.4 mt -83.73 115.79 26.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-O 121.362 0.601 . . . . 0.76 111.838 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -126.49 171.86 10.7 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 114.884 -1.053 . . . . 1.12 109.861 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.437 HG21 ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -57.09 -27.68 61.97 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.742 0.645 . . . . 1.08 112.742 179.405 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -68.1 -39.09 82.91 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.173 0.435 . . . . 0.77 112.173 -178.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.663 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 20.1 mp0 -84.92 -19.22 32.56 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 121.957 -0.464 . . . . 0.87 110.96 -178.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 20.4 tp -79.13 -41.2 29.1 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.894 -0.594 . . . . 1.12 110.237 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.33 -28.46 55.68 Favored Glycine 0 C--O 1.226 -0.372 0 C-N-CA 120.946 -0.645 . . . . 0.36 113.843 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.83 -25.66 68.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 117.419 0.61 . . . . 0.54 111.288 -179.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.2 t -80.31 -55.69 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 N-CA-C 109.573 -0.528 . . . . 1.97 109.573 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 33.7 mtt -54.47 -39.62 67.65 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.149 0.499 . . . . 1.24 111.035 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -62.4 -38.44 89.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.576 -0.738 . . . . 2.37 111.867 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.2 m -93.12 2.45 56.71 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.078 0.466 . . . . 0.99 111.796 -177.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.0 tp -109.35 -57.91 2.1 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.835 -0.621 . . . . 1.21 110.773 -179.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -145.8 44.61 0.85 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 119.988 -1.101 . . . . 0.56 113.323 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 73.08 140.62 0.06 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.68 0.752 . . . . 3.6 111.834 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -81.68 138.05 47.43 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.384 -0.825 . . . . 0.96 110.496 -179.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.72 -165.55 0.3 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.804 2.336 . . . . 0.72 112.862 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 68.6 p -79.3 161.82 26.02 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.949 -0.389 . . . . 1.09 109.949 178.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -59.27 -36.95 76.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.788 0.327 . . . . 2.13 110.483 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.3 -47.13 80.66 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.408 -0.36 . . . . 0.8 110.175 179.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -63.25 -40.95 98.85 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.119 0.485 . . . . 0.81 110.282 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.437 ' HG ' HG21 ' A' ' 29' ' ' THR . 55.3 tp -59.03 -43.6 91.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.444 -0.798 . . . . 0.94 111.072 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.539 ' O ' HG22 ' A' ' 52' ' ' ILE . 19.1 tt0 -75.74 -35.06 60.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.044 -0.525 . . . . 1.31 111.665 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -68.04 -25.42 65.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.925 0.393 . . . . 1.42 110.844 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.9 mmm -64.37 -44.96 89.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.364 -0.38 . . . . 0.78 110.068 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.539 HG22 ' O ' ' A' ' 49' ' ' GLN . 6.9 tp -70.92 -21.35 22.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.077 0.465 . . . . 1.05 109.976 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -78.21 -17.73 56.36 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.994 -0.743 . . . . 1.4 108.994 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.486 ' HG3' ' H ' ' B' ' 288' ' ' ALA . 19.3 tp10 -95.81 -0.67 50.91 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.418 -0.81 . . . . 1.58 111.239 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.767 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 1.0 OUTLIER -122.22 -46.27 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 N-CA-C 112.177 0.436 . . . . 1.37 112.177 -179.756 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.638 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 13.6 t70 -76.52 99.75 5.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.41 0.624 . . . . 0.7 111.288 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.71 -22.62 46.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.182 -0.917 . . . . 1.17 111.425 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -76.56 -0.78 24.44 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.194 -0.457 . . . . 0.85 111.967 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.97 46.37 84.45 Favored Glycine 0 C--O 1.224 -0.487 0 C-N-CA 121.554 -0.355 . . . . 1.03 113.977 178.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -127.46 -17.66 4.6 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.419 0.628 . . . . 2.17 109.697 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 76.64 24.08 68.43 Favored Glycine 0 N--CA 1.452 -0.238 0 CA-C-N 115.537 -0.756 . . . . 0.73 112.921 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.0 m -151.75 146.71 25.94 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.938 0.399 . . . . 0.9 110.552 179.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.455 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 0.9 OUTLIER -123.93 109.07 22.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.283 0.564 . . . . 0.95 110.023 179.12 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -78.81 -176.65 5.07 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.296 -0.866 . . . . 1.09 110.062 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.487 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 74.8 m-85 -57.72 -53.63 63.66 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 116.262 -0.426 . . . . 2.05 111.309 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 10.5 Cg_endo -56.23 -35.72 95.87 Favored 'Trans proline' 0 C--N 1.357 0.976 0 C-N-CA 122.497 2.131 . . . . 0.85 112.138 178.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.624 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 36.9 mt-10 -69.45 -39.21 77.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.164 -0.471 . . . . 0.66 110.047 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -59.66 -39.22 83.71 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.57 -0.741 . . . . 0.91 111.239 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 94.4 mt -64.29 -36.6 84.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.249 0.547 . . . . 1.23 110.599 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.6 m -80.41 -39.6 28.03 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.702 -0.681 . . . . 1.14 111.333 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.468 ' HE3' ' HA ' ' B' ' 289' ' ' ALA . 7.3 tpt -62.69 -54.45 39.21 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.85 -0.614 . . . . 1.24 112.056 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.407 ' HE1' ' HB3' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -72.17 -4.61 30.24 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.708 0.632 . . . . 0.99 112.708 -177.647 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -101.48 2.9 39.74 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.995 0.426 . . . . 1.21 110.287 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' A' ' 74' ' ' ARG . 0.1 OUTLIER -124.88 78.3 1.68 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.038 -0.528 . . . . 2.96 111.051 -179.209 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.5 pttm -86.21 169.65 12.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.841 0.353 . . . . 3.81 110.649 179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 33.3 mtp -92.59 157.08 16.7 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.91 -0.586 . . . . 3.21 111.346 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -101.75 14.3 32.35 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.21 0.529 . . . . 2.74 111.386 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -92.42 171.39 9.07 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.124 -0.489 . . . . 2.35 110.346 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -74.32 122.68 23.28 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 110.081 -0.34 . . . . 3.53 110.081 179.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.143 0 CA-C-O 119.224 -0.417 . . . . 3.21 110.861 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . 0.414 ' HB3' ' OD1' ' B' ' 290' ' ' ASN . 4.4 ttm180 . . . . . 0 N--CA 1.477 0.91 0 N-CA-C 109.858 -0.423 . . . . 3.73 109.858 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . 0.548 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -67.26 -20.44 65.66 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 112.568 0.581 . . . . 1.26 112.568 -178.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . 0.562 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -72.06 -3.49 23.31 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-O 121.356 0.598 . . . . 1.22 112.111 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . 0.414 ' OD1' ' HB3' ' B' ' 287' ' ' ARG . 3.2 m120 -111.86 -33.76 6.21 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 122.578 1.18 . . . . 0.96 109.893 175.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . 0.415 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 8.1 mp -79.74 -13.11 59.68 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 114.267 -1.333 . . . . 1.85 110.283 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.767 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 3.4 m0 -86.88 -54.65 0.38 Allowed Pre-proline 0 CA--C 1.531 0.222 0 N-CA-C 107.385 -1.339 . . . . 0.54 107.385 175.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.562 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 18.3 Cg_exo -49.23 -33.21 27.45 Favored 'Trans proline' 0 C--N 1.366 1.465 0 C-N-CA 122.631 2.221 . . . . 0.58 112.812 174.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.561 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 13.7 t -58.22 -63.43 3.96 Favored Pre-proline 0 CA--C 1.547 0.837 0 CA-C-O 118.999 -0.524 . . . . 1.39 110.847 179.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.561 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 76.1 Cg_exo -52.22 -35.82 64.86 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 122.243 1.962 . . . . 0.6 112.236 176.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 18.7 tp -69.09 -31.42 70.13 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.054 0.454 . . . . 1.08 109.782 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 15.5 ttt -71.73 -42.55 67.15 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.175 -1.046 . . . . 2.31 108.175 178.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 42.0 mm -62.74 -33.14 58.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 107.94 -1.133 . . . . 1.13 107.94 176.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . 0.445 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.1 OUTLIER -64.31 -36.92 85.69 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 108.66 -0.867 . . . . 1.11 108.66 177.664 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -66.7 -36.24 82.02 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.742 -0.836 . . . . 2.87 108.742 178.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 12.8 m -66.9 -38.33 86.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.973 -1.012 . . . . 0.91 109.275 178.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.45 -35.41 65.75 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.105 -0.702 . . . . 2.89 109.105 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -66.72 -36.06 81.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.399 0.619 . . . . 1.29 109.439 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -72.17 -39.92 68.32 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.197 -0.91 . . . . 1.36 109.145 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 8.4 m . . . . . 0 C--O 1.252 1.2 0 CA-C-O 118.239 -0.886 . . . . 1.39 110.149 179.356 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' ' CA' . . . . . 0.663 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' ' CA' . . . . . 0.638 'CA ' ' OD1' ' A' ' 56' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 . . . . . 0 N--CA 1.452 -0.359 0 N-CA-C 111.551 0.204 . . . . 1.18 111.551 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -74.49 -40.93 61.53 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.08 -0.711 . . . . 1.27 109.08 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -68.43 -22.36 64.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.455 -0.793 . . . . 0.99 110.331 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.4 ' CG ' ' HE3' ' B' ' 299' ' ' LYS . 5.1 tp10 -69.62 -27.12 64.81 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.653 -0.703 . . . . 1.29 110.478 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.32 -47.6 85.19 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.673 -0.491 . . . . 0.58 109.673 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -73.89 3.46 6.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.069 0.462 . . . . 0.98 111.61 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.4 m -112.76 -35.0 5.62 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.258 -0.428 . . . . 0.73 111.886 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.433 HD12 ' HG2' ' B' ' 299' ' ' LYS . 79.4 mt -105.13 -26.44 12.09 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.144 0.424 . . . . 0.55 112.144 -178.762 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -83.0 -49.06 9.97 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 121.043 -0.263 . . . . 0.79 111.318 -178.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -92.24 140.02 30.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.955 0.407 . . . . 0.59 111.166 -179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -125.43 3.44 7.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.0 -0.545 . . . . 1.57 110.5 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -90.17 -28.6 18.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.161 0.505 . . . . 0.82 109.976 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.89 27.7 9.34 Favored Glycine 0 N--CA 1.444 -0.784 0 N-CA-C 111.118 -0.793 . . . . 0.87 111.118 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -100.48 -31.54 11.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.305 -0.448 . . . . 0.74 111.126 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 69.45 36.99 78.58 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.867 -0.683 . . . . 1.3 112.085 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.4 HG22 ' HA ' ' A' ' 64' ' ' ASP . 5.3 p -139.4 152.96 47.52 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.823 -0.436 . . . . 0.66 109.823 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.444 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 74.5 mt -101.86 111.52 31.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-O 120.975 0.417 . . . . 0.5 110.936 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.7 p -118.71 -178.93 3.66 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.913 -0.773 . . . . 0.77 108.913 178.08 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.27 -30.45 60.13 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.288 -0.414 . . . . 0.59 111.739 178.432 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -64.71 -46.43 82.35 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.949 -0.568 . . . . 0.56 112.313 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 50.4 mp0 -81.88 -25.87 34.66 Favored 'General case' 0 C--N 1.332 -0.165 0 O-C-N 121.903 -0.498 . . . . 0.87 111.095 -177.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.5 tp -71.51 -33.55 69.32 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.531 -0.758 . . . . 0.47 110.755 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -91.41 -29.22 12.62 Favored Glycine 0 C--O 1.229 -0.187 0 C-N-CA 120.651 -0.785 . . . . 0.36 113.908 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -60.67 -40.73 93.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 117.354 0.577 . . . . 0.47 112.483 -178.219 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.411 HG11 ' HB3' ' B' ' 295' ' ' PRO . 7.3 p -67.5 -48.21 77.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 121.047 -0.261 . . . . 1.38 110.661 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 43.6 mtt -61.24 -36.63 80.49 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.784 0.326 . . . . 0.85 110.432 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 -56.58 -33.29 66.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.243 -0.89 . . . . 1.95 111.639 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 m -112.38 24.79 12.15 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.178 0.513 . . . . 0.59 111.019 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 22.7 tp -125.6 -49.02 1.65 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.031 -0.531 . . . . 0.72 111.124 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -155.5 43.7 0.55 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 121.015 -0.612 . . . . 0.56 112.214 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 71.67 143.32 0.06 Allowed 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.368 0.667 . . . . 2.83 111.165 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -88.05 133.0 38.12 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.703 -0.68 . . . . 0.96 110.822 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -74.54 -177.34 3.28 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.719 2.28 . . . . 0.61 111.307 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.3 p -78.39 165.15 24.15 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.877 -0.329 . . . . 0.8 110.719 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -57.52 -40.88 79.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.895 0.378 . . . . 2.13 110.957 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.07 -45.53 92.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.7 110.809 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -63.41 -36.55 84.12 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.443 -0.799 . . . . 0.81 111.059 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.7 tp -72.36 -38.29 68.6 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.266 -0.425 . . . . 0.76 110.174 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -59.89 -46.2 90.11 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.594 -0.73 . . . . 1.12 110.316 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -64.52 -37.1 86.37 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.498 -0.774 . . . . 1.42 110.792 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.491 ' O ' HG12 ' A' ' 55' ' ' VAL . 4.1 mmm -63.42 -46.41 86.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.905 -0.588 . . . . 0.54 112.504 -178.736 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 8.4 tp -72.1 -25.97 24.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 120.536 -0.466 . . . . 0.59 110.153 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -75.13 -21.74 58.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.65 0.738 . . . . 1.06 109.667 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.591 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 24.0 tt0 -84.08 -7.09 59.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.855 -1.066 . . . . 1.58 111.058 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.748 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -118.29 -48.95 3.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.451 -0.341 . . . . 0.82 111.234 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -75.01 101.43 4.48 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.781 0.324 . . . . 0.7 110.296 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -7.86 56.09 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.044 -0.526 . . . . 0.9 111.535 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.02 -27.85 39.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.989 0.423 . . . . 0.85 111.094 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 92.99 44.8 3.75 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.681 -0.771 . . . . 1.03 114.705 177.221 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -144.61 -11.97 0.59 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.282 0.541 . . . . 1.61 111.138 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 75.49 26.08 66.44 Favored Glycine 0 C--N 1.33 0.239 0 C-N-CA 120.701 -0.761 . . . . 0.67 112.582 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 93.8 m -138.89 134.83 33.77 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.097 0.475 . . . . 0.65 110.97 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.519 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 0.4 OUTLIER -119.38 119.31 60.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.553 -0.748 . . . . 0.5 110.313 178.59 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.4 ' HA ' HG22 ' A' ' 26' ' ' THR . 3.6 t70 -95.08 -173.17 2.88 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.646 -0.706 . . . . 1.09 110.043 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.519 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 15.1 m-85 -56.6 -52.97 69.4 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.368 -0.378 . . . . 1.78 111.498 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.7 Cg_endo -54.21 -37.2 87.79 Favored 'Trans proline' 0 C--N 1.364 1.365 0 C-N-CA 122.622 2.215 . . . . 0.79 112.258 178.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.425 ' HB2' HG23 ' A' ' 63' ' ' ILE . 29.1 mt-10 -72.95 -46.01 54.83 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.193 0.52 . . . . 0.66 110.481 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -59.29 -37.46 77.74 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.3 -0.864 . . . . 0.77 111.041 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 62.9 mt -59.65 -30.02 68.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.993 -0.549 . . . . 0.9 111.808 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.82 -37.6 10.67 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.194 0.521 . . . . 1.02 110.987 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.56 ' HE1' ' HA ' ' B' ' 289' ' ' ALA . 14.4 tpt -59.96 -48.94 79.63 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.596 -0.729 . . . . 0.69 112.102 -179.261 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.87 26.09 1.63 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.88 0.326 . . . . 0.99 111.88 -178.484 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -132.02 -36.85 1.16 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.998 0.428 . . . . 1.21 111.342 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.234 0.259 0 CA-C-O 120.766 0.317 . . . . 2.56 111.733 -178.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 287' ' ' ARG . . . . . 0.591 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 110.28 -0.267 . . . . 3.11 110.28 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.531 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . . . -59.93 -31.32 69.74 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-O 120.715 0.293 . . . . 0.6 110.753 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 289' ' ' ALA . . . . . 0.56 ' HA ' ' HE1' ' A' ' 71' ' ' MET . . . -68.57 -14.08 62.77 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 120.844 -0.342 . . . . 0.65 111.435 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 290' ' ' ASN . . . . . 0.496 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 3.5 m120 -102.68 -38.97 7.25 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.01 0.909 . . . . 0.87 109.292 175.03 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 1.1 mp -73.57 -10.28 59.55 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.944 -0.571 . . . . 1.37 111.155 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.748 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 2.6 m0 -87.15 -52.66 0.41 Allowed Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 107.766 -1.198 . . . . 0.42 107.766 175.853 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.516 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 12.8 Cg_exo -51.55 -33.82 49.66 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 123.454 2.77 . . . . 0.54 112.903 174.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.585 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 14.4 t -58.1 -60.11 11.13 Favored Pre-proline 0 CA--C 1.547 0.845 0 CA-C-O 119.203 -0.427 . . . . 0.95 110.903 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.585 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 78.8 Cg_exo -55.61 -34.37 89.94 Favored 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 122.025 1.816 . . . . 0.54 111.887 176.322 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 9.4 tp -65.35 -33.66 76.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.187 0.517 . . . . 0.56 109.745 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 2.7 ttt -67.84 -32.99 73.9 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.472 -0.936 . . . . 1.79 108.472 177.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 48.5 mm -69.99 -37.2 71.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.343 -0.984 . . . . 0.5 108.343 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 299' ' ' LYS . . . . . 0.564 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.1 OUTLIER -63.45 -42.23 98.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.169 -0.923 . . . . 0.51 109.264 178.092 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -40.34 94.38 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.258 -0.645 . . . . 2.44 109.258 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 53.7 m -64.54 -39.25 93.41 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.712 -0.676 . . . . 0.66 110.022 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -69.69 -34.61 74.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.086 -0.506 . . . . 2.44 109.89 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -66.44 -28.46 68.62 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.711 0.767 . . . . 0.82 109.503 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -85.5 -36.65 20.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.965 -1.016 . . . . 1.16 109.984 178.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 11.7 m . . . . . 0 C--O 1.255 1.35 0 CA-C-O 118.845 -0.598 . . . . 1.39 110.039 179.083 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 . . . . . 0 C--O 1.234 0.239 0 CA-C-O 120.417 0.151 . . . . 1.18 111.398 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -71.23 -42.68 68.57 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 120.993 0.425 . . . . 1.27 111.537 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 80.1 mttt -68.73 -19.81 64.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.084 -0.507 . . . . 0.99 110.049 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.44 ' HG3' ' CD1' ' A' ' 18' ' ' LEU . 2.2 tp10 -69.61 -30.79 68.61 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.455 -0.793 . . . . 1.29 110.295 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.512 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -61.04 -46.0 92.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.297 -0.411 . . . . 0.58 110.113 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -84.52 29.29 0.6 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.107 0.48 . . . . 0.98 110.779 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.7 m -137.06 -38.17 0.63 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.947 -0.569 . . . . 0.73 110.712 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.457 HD12 ' HG2' ' B' ' 299' ' ' LYS . 23.3 mt -109.46 -37.91 5.6 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 111.998 0.37 . . . . 0.55 111.998 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.512 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 78.1 t80 -67.26 -43.45 81.83 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.817 0.341 . . . . 0.79 110.396 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -92.29 144.62 25.21 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.002 -0.74 . . . . 0.59 109.002 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -119.37 -2.58 10.58 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.784 -0.367 . . . . 1.57 111.761 -178.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -93.23 -42.0 9.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.034 0.445 . . . . 0.82 110.547 -178.541 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 119.48 0.49 13.98 Favored Glycine 0 N--CA 1.442 -0.964 0 CA-C-N 115.456 -0.793 . . . . 0.87 111.651 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -75.61 -46.61 30.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.79 0.329 . . . . 0.74 111.155 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.99 26.22 41.96 Favored Glycine 0 CA--C 1.518 0.267 0 CA-C-N 116.264 -0.425 . . . . 1.3 112.295 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.9 152.05 31.34 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 110.4 -0.222 . . . . 0.66 110.4 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.564 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 10.7 mt -94.53 105.83 17.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.395 0.617 . . . . 0.5 110.802 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.86 165.84 17.33 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 114.786 -1.097 . . . . 0.77 109.215 178.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.82 -33.94 51.53 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.239 0.459 . . . . 0.59 112.239 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -61.85 -46.08 91.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.083 -0.508 . . . . 0.56 112.043 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.7 mp0 -77.12 -25.01 51.65 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.886 0.374 . . . . 0.87 110.95 -178.251 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.472 HD21 ' HE2' ' A' ' 51' ' ' MET . 18.3 tp -76.23 -47.25 24.63 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 116.031 -0.532 . . . . 0.47 110.271 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.99 -36.83 86.96 Favored Glycine 0 C--N 1.333 0.371 0 CA-C-N 115.637 -0.711 . . . . 0.36 114.091 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 p -59.94 -31.49 69.91 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 117.285 0.543 . . . . 0.47 112.406 -178.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.8 t -72.93 -53.42 18.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.811 -0.44 . . . . 1.38 109.811 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 23.9 mtt -58.73 -41.22 85.89 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.734 -0.666 . . . . 0.85 111.457 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.454 ' HG3' ' HB2' ' A' ' 42' ' ' ASN . 1.1 ttt180 -59.49 -43.06 93.42 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.373 -0.376 . . . . 1.95 111.059 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 69.0 m -85.33 -3.69 58.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.978 0.418 . . . . 0.59 111.848 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.0 tp -100.93 -62.13 1.28 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.806 0.336 . . . . 0.72 111.295 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -149.08 62.97 0.41 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.528 -0.844 . . . . 0.56 112.726 -178.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 69.5 158.64 0.17 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.579 0.704 . . . . 2.83 112.043 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.454 ' HB2' ' HG3' ' A' ' 37' ' ' ARG . 3.9 t30 -105.94 135.01 19.48 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.838 -0.619 . . . . 0.96 110.57 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -75.95 -168.04 0.51 Allowed 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.344 2.029 . . . . 0.61 111.45 178.019 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.5 p -80.39 165.92 21.77 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 110.311 -0.255 . . . . 0.8 110.311 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -65.19 -32.72 74.54 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.556 -0.535 . . . . 2.13 109.556 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.5 -50.09 71.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.726 -0.67 . . . . 0.7 110.15 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -64.92 -33.94 77.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.774 -0.648 . . . . 0.81 110.606 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 47.8 tp -62.81 -38.35 90.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.467 -0.788 . . . . 0.76 110.358 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.564 ' O ' HG22 ' A' ' 52' ' ' ILE . 6.6 tt0 -77.74 -42.07 35.53 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.885 -0.598 . . . . 1.12 110.123 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -59.51 -29.41 67.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.189 0.518 . . . . 1.42 110.455 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.472 ' HE2' HD21 ' A' ' 32' ' ' LEU . 1.7 mmm -69.21 -35.38 76.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.916 -0.584 . . . . 0.54 110.853 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 49' ' ' GLN . 5.0 tp -80.85 -13.09 12.8 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-O 121.467 0.651 . . . . 0.59 109.546 179.246 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -81.16 -27.18 35.54 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.497 -0.774 . . . . 1.06 109.32 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.609 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 22.3 tt0 -94.41 36.37 1.16 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.584 -0.734 . . . . 1.58 110.274 178.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.809 ' HB ' ' HB3' ' B' ' 288' ' ' ALA . 7.1 p -164.59 -32.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 C-N-CA 119.965 -0.694 . . . . 0.82 112.592 -177.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -93.09 80.13 4.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.99 0.424 . . . . 0.7 110.303 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.72 -28.46 61.05 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.55 -0.75 . . . . 0.9 112.791 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -69.48 -14.48 62.9 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.881 0.372 . . . . 0.85 110.828 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.55 51.48 58.47 Favored Glycine 0 C--N 1.333 0.373 0 CA-C-N 116.277 -0.42 . . . . 1.03 113.044 178.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -124.29 -25.7 4.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.17 0.51 . . . . 1.61 110.376 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.2 14.59 47.83 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.799 -0.637 . . . . 0.67 111.891 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.5 m -152.42 139.06 18.75 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 120.995 0.426 . . . . 0.65 111.379 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.647 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.4 OUTLIER -116.13 118.52 59.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 108.737 -0.838 . . . . 0.5 108.737 178.347 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -91.81 -172.39 3.18 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.645 -0.502 . . . . 1.09 109.645 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.491 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 31.0 m-85 -55.88 -53.92 57.8 Favored Pre-proline 0 CA--C 1.532 0.263 0 O-C-N 123.085 0.24 . . . . 1.78 111.17 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.7 Cg_endo -50.93 -43.18 48.86 Favored 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 122.236 1.957 . . . . 0.79 112.02 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.425 ' OE1' ' HA ' ' A' ' 63' ' ' ILE . 20.2 mt-10 -69.69 -43.22 72.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.362 -0.381 . . . . 0.66 110.759 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -56.77 -40.98 76.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.833 -0.621 . . . . 0.77 111.335 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.29 -34.75 77.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.686 -0.688 . . . . 0.9 110.7 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.7 m -81.79 -41.82 20.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.132 -0.485 . . . . 1.02 111.137 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.473 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 5.6 tpt -61.92 -50.09 73.58 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.516 0.562 . . . . 0.69 112.516 -178.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.67 -15.1 61.71 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.12 -0.632 . . . . 0.99 112.367 -178.162 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -96.69 -13.16 22.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.141 0.496 . . . . 1.21 110.262 178.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.331 -0.227 0 CA-C-N 115.741 -0.663 . . . . 2.56 110.307 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 287' ' ' ARG . . . . . 0.609 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 5.2 ttm180 . . . . . 0 N--CA 1.477 0.899 0 CA-C-O 120.718 0.294 . . . . 3.11 110.556 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.809 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -63.21 -31.61 72.8 Favored 'General case' 0 C--O 1.216 -0.709 0 N-CA-C 112.621 0.6 . . . . 0.6 112.621 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 289' ' ' ALA . . . . . 0.529 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -63.64 -3.52 2.31 Favored 'General case' 0 C--O 1.216 -0.658 0 N-CA-C 113.335 0.865 . . . . 0.65 113.335 -179.394 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -111.42 -35.97 5.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 122.286 1.041 . . . . 0.87 109.973 177.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 291' ' ' LEU . . . . . 0.4 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 8.2 mp -80.22 -8.36 59.41 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 114.077 -1.419 . . . . 1.37 109.979 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.69 ' CE2' HG21 ' A' ' 55' ' ' VAL . 6.5 m0 -90.72 -54.56 0.28 Allowed Pre-proline 0 CA--C 1.535 0.394 0 N-CA-C 107.176 -1.416 . . . . 0.42 107.176 175.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.539 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 21.4 Cg_exo -50.77 -32.81 38.16 Favored 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 122.751 2.301 . . . . 0.54 112.571 174.002 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.572 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 19.5 t -59.78 -61.76 7.24 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-O 119.124 -0.465 . . . . 0.95 110.688 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.572 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 93.1 Cg_exo -52.06 -36.23 64.77 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 121.594 1.529 . . . . 0.54 112.215 176.221 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 14.2 tp -65.21 -32.68 74.48 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.347 0.594 . . . . 0.56 109.735 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 17.7 ttt -73.31 -45.36 55.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.208 -0.906 . . . . 1.79 108.926 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 46.2 mm -61.1 -33.65 56.92 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 N-CA-C 108.881 -0.785 . . . . 0.5 108.881 178.188 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 299' ' ' LYS . . . . . 0.567 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.2 OUTLIER -62.95 -43.85 97.65 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.18 -0.918 . . . . 0.51 109.105 178.21 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -41.62 89.7 Favored 'General case' 0 C--N 1.333 -0.113 0 N-CA-C 108.945 -0.761 . . . . 2.44 108.945 178.545 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 67.9 m -65.01 -42.86 94.06 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.619 -0.719 . . . . 0.66 110.676 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 22.5 tptp -67.49 -36.24 80.72 Favored 'General case' 0 C--O 1.225 -0.219 0 N-CA-C 110.014 -0.365 . . . . 2.44 110.014 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 3.2 tttp -63.48 -30.45 71.57 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.942 -0.762 . . . . 0.82 108.942 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -82.07 -31.59 30.74 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.099 -0.955 . . . . 1.16 109.907 178.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.8 m . . . . . 0 C--O 1.247 0.926 0 CA-C-N 115.453 -0.794 . . . . 1.39 111.216 179.827 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.236 0.373 0 CA-C-O 121.016 0.436 . . . . 1.18 110.063 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -69.25 -32.72 72.13 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.439 0.637 . . . . 1.27 109.317 178.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -70.34 -20.23 63.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.294 -0.866 . . . . 0.99 111.202 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.561 ' HG3' HD12 ' A' ' 18' ' ' LEU . 3.7 tp10 -66.94 -24.61 66.1 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 109.181 -0.674 . . . . 1.29 109.181 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 19' ' ' PHE . . . -69.28 -37.42 77.85 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.743 -0.466 . . . . 0.58 109.743 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -86.59 14.98 6.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.883 0.373 . . . . 0.98 110.754 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.3 m -129.03 -35.45 1.84 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.952 0.406 . . . . 0.73 110.914 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.561 HD12 ' HG3' ' A' ' 14' ' ' GLU . 44.6 mt -99.37 -28.55 13.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.277 -0.419 . . . . 0.55 111.938 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.447 ' HB2' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -80.93 -57.6 3.47 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.225 0.536 . . . . 0.79 110.005 -179.012 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -82.4 142.0 32.32 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.004 -0.998 . . . . 0.59 111.146 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -128.89 6.8 5.53 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.104 -0.702 . . . . 1.57 109.104 178.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -95.08 -25.72 16.34 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.849 -0.614 . . . . 0.82 111.643 -178.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.05 22.14 23.64 Favored Glycine 0 N--CA 1.442 -0.914 0 N-CA-C 110.709 -0.956 . . . . 0.87 110.709 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -95.8 -32.8 12.52 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.641 -0.503 . . . . 0.74 109.641 179.12 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.16 28.74 73.82 Favored Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.863 -0.684 . . . . 1.3 112.878 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.5 p -132.35 128.16 37.06 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 122.932 -0.158 . . . . 0.66 111.227 -179.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.474 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 47.9 mt -75.14 112.19 12.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 120.97 0.414 . . . . 0.5 111.379 -179.312 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.5 p -117.8 177.87 4.61 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.417 -0.811 . . . . 0.77 108.815 178.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.457 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -58.02 -28.24 64.27 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.779 0.323 . . . . 0.59 111.143 178.207 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 44.6 tttt -65.88 -44.63 84.78 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 112.175 0.435 . . . . 0.56 112.175 -179.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.3 mp0 -78.98 -22.03 46.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.95 0.405 . . . . 0.87 111.143 -178.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.4 tp -83.46 -38.66 21.55 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.096 -0.502 . . . . 0.47 110.748 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.18 -32.75 51.45 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.736 -0.745 . . . . 0.36 113.619 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -60.41 -44.91 95.25 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.272 0.471 . . . . 0.47 112.272 -178.442 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.5 p -66.5 -48.33 80.9 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 120.978 -0.289 . . . . 1.38 110.734 -178.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 56.6 mtt -56.56 -46.38 80.75 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.718 0.294 . . . . 0.85 111.538 178.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -58.39 -29.5 66.09 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.172 -0.467 . . . . 1.95 111.313 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.0 m -99.05 3.88 46.92 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.13 -0.486 . . . . 0.59 111.337 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.5 tp -113.97 -34.14 5.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.314 -0.403 . . . . 0.72 111.408 -178.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -169.3 53.23 0.21 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.225 -0.988 . . . . 0.56 112.829 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 72.89 175.9 0.27 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.495 0.664 . . . . 2.83 111.894 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -116.76 123.72 30.07 Favored Pre-proline 0 C--N 1.318 -0.791 0 CA-C-N 115.273 -0.876 . . . . 0.96 109.56 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -77.48 -163.92 0.24 Allowed 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.162 1.908 . . . . 0.61 111.106 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.6 p -82.55 158.97 22.91 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.01 -0.676 . . . . 0.8 110.195 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.3 mp0 -57.15 -35.28 69.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.97 -0.559 . . . . 2.13 110.533 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.3 -46.14 91.54 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.425 0.631 . . . . 0.7 110.165 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -64.96 -41.11 95.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.216 -0.902 . . . . 0.81 110.37 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.457 ' HG ' HG22 ' A' ' 29' ' ' THR . 18.9 tp -65.05 -43.08 93.48 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.738 -0.664 . . . . 0.76 110.216 179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.476 ' O ' HG22 ' A' ' 52' ' ' ILE . 14.7 tt0 -66.59 -46.76 74.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.288 -0.415 . . . . 1.12 110.66 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -56.18 -35.5 67.31 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.044 0.45 . . . . 1.42 110.741 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.466 ' O ' HG12 ' A' ' 55' ' ' VAL . 2.9 mmm -66.72 -45.96 77.01 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.504 -0.771 . . . . 0.54 111.265 -179.575 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.476 HG22 ' O ' ' A' ' 49' ' ' GLN . 8.9 tp -69.5 -22.99 25.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-O 121.096 0.474 . . . . 0.59 110.251 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.54 -24.97 41.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.675 0.75 . . . . 1.06 109.193 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.497 ' HB3' ' HB2' ' B' ' 288' ' ' ALA . 9.1 tp10 -77.41 -9.54 58.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.01 -0.995 . . . . 1.58 110.372 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.704 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 0.7 OUTLIER -118.9 -49.72 3.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.292 -0.413 . . . . 0.82 111.849 -179.699 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -79.4 103.8 9.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 0.7 110.841 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.32 -25.69 46.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.867 -0.606 . . . . 0.9 112.598 -178.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -64.14 -39.25 93.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.683 -0.235 . . . . 0.85 111.419 -179.031 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 101.99 31.21 5.46 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.38 -0.914 . . . . 1.03 113.332 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -127.86 -6.04 5.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.84 0.352 . . . . 1.61 110.807 179.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.48 34.69 88.51 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.663 -0.779 . . . . 0.67 112.252 179.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.7 m -142.74 131.69 22.96 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 110.014 -0.365 . . . . 0.65 110.014 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.546 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.1 OUTLIER -113.35 121.71 66.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.141 0.496 . . . . 0.5 111.16 179.662 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -92.43 -176.96 4.47 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.488 -0.778 . . . . 1.09 110.747 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.509 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 36.1 m-85 -52.92 -54.9 38.7 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 116.467 -0.333 . . . . 1.78 111.788 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.8 Cg_endo -59.13 -32.57 97.47 Favored 'Trans proline' 0 C--N 1.36 1.152 0 C-N-CA 122.121 1.881 . . . . 0.79 113.674 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -70.39 -42.88 71.12 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.252 0.549 . . . . 0.66 110.296 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -66.68 -44.34 82.01 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.584 -0.734 . . . . 0.77 110.73 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 81.4 mt -59.73 -29.62 68.26 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.427 -0.352 . . . . 0.9 111.409 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.7 m -81.92 -44.6 16.58 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.097 0.406 . . . . 1.02 112.097 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.639 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 24.5 ttt -67.27 -49.73 63.22 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.676 0.621 . . . . 0.69 112.676 -178.235 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.453 ' HE1' ' HB3' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -74.34 3.45 7.35 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.892 0.701 . . . . 0.99 112.892 -178.122 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -115.44 -11.08 11.88 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.257 0.551 . . . . 1.21 109.997 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.509 0 CA-C-N 115.473 -0.785 . . . . 2.56 110.173 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 287' ' ' ARG . . . . . 0.43 ' HB3' ' OD1' ' B' ' 290' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 109.488 -0.56 . . . . 3.11 109.488 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.497 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . . . -72.25 -24.8 61.42 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-O 121.232 0.539 . . . . 0.6 110.975 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 289' ' ' ALA . . . . . 0.639 ' HA ' ' CE ' ' A' ' 71' ' ' MET . . . -68.53 -0.55 5.21 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.219 0.822 . . . . 0.65 113.219 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 290' ' ' ASN . . . . . 0.511 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 2.9 m120 -114.38 -36.47 4.63 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 123.233 1.492 . . . . 0.87 109.745 176.105 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 6.4 mt -80.82 -3.06 49.76 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 113.018 -1.901 . . . . 1.37 111.156 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.704 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 3.1 m0 -100.04 -52.7 0.18 Allowed Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 107.449 -1.315 . . . . 0.42 107.449 174.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.59 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 11.6 Cg_exo -49.54 -39.05 45.75 Favored 'Trans proline' 0 C--N 1.376 1.978 0 C-N-CA 122.969 2.446 . . . . 0.54 111.545 175.304 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.461 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 3.1 t -60.83 -64.05 3.58 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 108.617 -0.883 . . . . 0.95 108.617 177.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.461 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 2.8 Cg_exo -47.3 -36.17 22.16 Favored 'Trans proline' 0 C--N 1.359 1.11 0 C-N-CA 122.599 2.2 . . . . 0.54 112.834 174.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 13.0 tp -70.85 -37.49 73.14 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 120.725 0.298 . . . . 0.56 110.528 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 14.6 ttt -65.08 -36.25 83.74 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.522 -0.918 . . . . 1.79 108.522 178.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 30.9 mm -66.07 -37.52 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-N 114.776 -1.102 . . . . 0.5 108.434 176.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 299' ' ' LYS . . . . . 0.528 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.2 OUTLIER -65.08 -40.99 95.44 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 108.684 -0.858 . . . . 0.51 108.684 177.355 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 16.9 mtp180 -61.91 -38.69 89.33 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.04 -0.726 . . . . 2.44 109.04 178.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 67.2 m -64.03 -45.21 89.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.562 -0.745 . . . . 0.66 110.339 178.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 15.6 tptp -68.56 -30.6 69.41 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.101 0.476 . . . . 2.44 109.863 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 6.1 tttp -68.2 -31.23 70.61 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.896 0.855 . . . . 0.82 108.796 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -77.41 -40.05 44.92 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.66 -1.155 . . . . 1.16 108.932 177.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 C--O 1.247 0.963 0 CA-C-N 115.61 -0.723 . . . . 1.39 111.025 178.836 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 . . . . . 0 C--O 1.237 0.434 0 CA-C-O 120.85 0.357 . . . . 1.18 110.734 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -72.38 -36.62 68.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.841 -0.618 . . . . 1.27 109.79 178.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -67.89 -26.4 65.98 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.824 -0.626 . . . . 0.99 110.227 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.508 ' HG2' ' HE3' ' B' ' 299' ' ' LYS . 4.9 tp10 -60.78 -33.63 73.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.54 -0.754 . . . . 1.29 109.939 178.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.01 -41.5 99.57 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.921 -0.581 . . . . 0.58 109.741 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -77.1 3.03 13.44 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.214 -0.448 . . . . 0.98 111.56 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 7.5 m -117.54 -36.98 3.56 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.194 -0.457 . . . . 0.73 111.486 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.457 HD12 ' HG2' ' B' ' 299' ' ' LYS . 89.1 mt -96.3 -20.09 18.78 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.102 0.408 . . . . 0.55 112.102 -179.084 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -85.86 -53.62 5.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.9 0.381 . . . . 0.79 110.216 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -83.06 142.58 31.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.481 -0.781 . . . . 0.59 111.631 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.8 mptt -127.77 -10.06 5.54 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.999 -0.546 . . . . 1.57 110.622 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.81 -41.46 30.2 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 120.983 0.421 . . . . 0.82 110.198 -178.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 115.94 1.62 20.81 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 111.187 -0.765 . . . . 0.87 111.187 -178.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -72.47 -36.09 68.38 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.885 -0.413 . . . . 0.74 109.885 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.54 35.78 62.74 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.871 -0.68 . . . . 1.3 112.467 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.76 145.7 38.59 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 110.273 -0.269 . . . . 0.66 110.273 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 65.1 mt -87.91 111.29 21.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 C-N-CA 120.661 -0.416 . . . . 0.5 110.793 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.3 p -123.65 -177.5 3.75 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.777 -0.823 . . . . 0.77 108.777 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.612 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -57.75 -30.94 66.0 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.474 0.546 . . . . 0.59 112.474 179.015 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -64.32 -48.23 76.41 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.03 0.752 . . . . 0.56 113.03 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.407 ' HA ' ' OG1' ' A' ' 34' ' ' THR . 51.1 mp0 -79.31 -22.52 44.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.449 0.642 . . . . 0.87 110.954 -177.589 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 35.8 tp -74.33 -35.97 63.64 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.2 -0.909 . . . . 0.47 110.742 -179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -88.26 -29.17 20.55 Favored Glycine 0 CA--C 1.518 0.246 0 C-N-CA 120.786 -0.721 . . . . 0.36 113.099 -179.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.407 ' OG1' ' HA ' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -60.78 -40.97 94.56 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.944 0.372 . . . . 0.47 111.541 -178.663 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.431 HG13 ' N ' ' A' ' 36' ' ' MET . 14.5 p -68.96 -48.29 71.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.523 -0.308 . . . . 1.38 110.403 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.431 ' N ' HG13 ' A' ' 35' ' ' VAL . 61.6 mtt -60.22 -42.27 94.81 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.675 -0.239 . . . . 0.85 111.267 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -35.07 74.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.306 -0.406 . . . . 1.95 110.769 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.7 m -91.09 0.35 57.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.259 -0.428 . . . . 0.59 111.367 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.3 tp -103.92 -57.89 1.96 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.782 0.325 . . . . 0.72 110.983 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -151.19 45.67 0.63 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.675 -0.774 . . . . 0.56 111.899 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 71.21 155.96 0.15 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.423 0.689 . . . . 2.83 110.984 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -106.6 138.0 19.63 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.25 -0.432 . . . . 0.96 110.853 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.38 -164.45 0.16 Allowed 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 122.572 2.181 . . . . 0.61 111.421 178.189 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.1 p -75.86 163.51 27.15 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.835 -0.346 . . . . 0.8 110.363 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -62.96 -30.45 71.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.045 -0.525 . . . . 2.13 110.963 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.87 -42.61 99.83 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.151 0.5 . . . . 0.7 110.667 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -71.56 -36.28 70.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.776 -0.647 . . . . 0.81 110.107 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.612 ' HG ' HG22 ' A' ' 29' ' ' THR . 59.6 tp -64.14 -45.76 87.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.619 -0.718 . . . . 0.76 110.381 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -69.11 -32.13 71.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.952 0.405 . . . . 1.12 110.829 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -69.71 -38.98 77.13 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.302 -0.408 . . . . 1.42 110.155 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.448 ' O ' HG12 ' A' ' 55' ' ' VAL . 4.9 mmm -57.5 -46.35 83.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.72 -0.673 . . . . 0.54 112.125 -179.631 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.404 ' HA ' ' CG1' ' A' ' 55' ' ' VAL . 8.8 tp -69.16 -22.44 26.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 120.603 -0.439 . . . . 0.59 111.263 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -22.83 51.83 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.212 0.53 . . . . 1.06 109.6 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.603 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 7.3 tt0 -82.36 -18.73 41.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.678 -0.692 . . . . 1.58 110.665 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.784 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -103.72 -48.33 10.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.153 0.427 . . . . 0.82 112.153 -179.71 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -83.35 106.01 14.77 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.274 0.559 . . . . 0.7 110.932 -179.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.2 -20.4 28.6 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.503 -0.771 . . . . 0.9 112.057 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.34 -29.43 69.62 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 110.037 -0.357 . . . . 0.85 110.037 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 91.41 34.15 7.63 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.77 -0.729 . . . . 1.03 114.11 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -129.65 -5.96 4.64 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 122.512 -0.405 . . . . 1.61 110.187 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.11 13.57 64.73 Favored Glycine 0 C--N 1.336 0.57 0 C-N-CA 121.282 -0.485 . . . . 0.67 112.954 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 3.9 m -119.04 130.07 55.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.751 0.31 . . . . 0.65 110.51 -179.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.631 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.4 OUTLIER -121.21 120.0 60.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.962 -0.563 . . . . 0.5 110.685 178.96 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -99.2 -172.91 2.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.164 -0.925 . . . . 1.09 109.955 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.528 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 4.3 m-85 -54.07 -54.97 41.39 Favored Pre-proline 0 N--CA 1.466 0.366 0 C-N-CA 122.549 0.339 . . . . 1.78 111.593 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.8 Cg_endo -52.13 -42.13 61.06 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 122.684 2.256 . . . . 0.79 112.775 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -69.0 -48.08 63.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.66 110.373 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -58.58 -47.42 84.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.511 -0.768 . . . . 0.77 111.75 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 70.2 mt -59.3 -26.75 65.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.209 -0.45 . . . . 0.9 111.811 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.5 m -93.55 -36.42 12.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.523 -0.308 . . . . 1.02 110.995 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.427 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 6.5 tpt -62.63 -47.94 81.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.69 111.47 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.26 2.88 6.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.102 -0.499 . . . . 0.99 111.3 -179.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -119.8 11.88 11.99 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.212 0.53 . . . . 1.21 110.364 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.2 mmm180 . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.8 -0.636 . . . . 2.56 110.858 -179.833 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 287' ' ' ARG . . . . . 0.603 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 1.5 ttm180 . . . . . 0 N--CA 1.479 1.005 0 N-CA-C 109.833 -0.432 . . . . 3.11 109.833 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 288' ' ' ALA . . . . . . . . . . . . . . . -57.95 -30.57 66.08 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 113.148 0.796 . . . . 0.6 113.148 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 289' ' ' ALA . . . . . 0.699 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -67.67 -15.27 63.56 Favored 'General case' 0 C--O 1.201 -1.478 0 CA-C-O 118.728 -0.653 . . . . 0.65 109.838 -178.584 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -98.45 -40.34 8.32 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 118.477 0.58 . . . . 0.87 110.884 174.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 9.0 mp -75.2 -9.91 58.98 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 115.545 -0.752 . . . . 1.37 111.263 -179.28 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.784 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 2.2 m95 -88.92 -54.59 0.32 Allowed Pre-proline 0 C--N 1.321 -0.638 0 N-CA-C 107.601 -1.259 . . . . 0.42 107.601 175.344 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.699 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 6.6 Cg_exo -48.02 -36.76 28.6 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 123.653 2.902 . . . . 0.54 113.141 174.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.529 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 12.5 t -59.39 -62.03 6.67 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 119.126 -0.464 . . . . 0.95 111.332 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.529 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 92.7 Cg_exo -51.33 -35.87 55.48 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 122.016 1.811 . . . . 0.54 112.178 176.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 46.3 tp -66.95 -38.44 86.12 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.719 -0.474 . . . . 0.56 109.719 178.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 27.5 ttt -63.53 -37.07 85.91 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.52 -0.919 . . . . 1.79 108.52 177.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 44.0 mm -64.33 -38.99 83.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 108.379 -0.971 . . . . 0.5 108.379 177.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 299' ' ' LYS . . . . . 0.508 ' HE3' ' HG2' ' A' ' 14' ' ' GLU . 0.1 OUTLIER -62.16 -44.17 97.21 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.866 -0.606 . . . . 0.51 109.474 178.087 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -62.83 -38.2 89.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.743 -0.662 . . . . 2.44 109.769 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 22.7 m -67.75 -33.89 75.74 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.929 -0.578 . . . . 0.66 109.833 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -77.27 -29.68 54.01 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.14 -0.689 . . . . 2.44 109.14 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 303' ' ' LYS . . . . . 0.498 ' HG3' ' HG2' ' A' ' 14' ' ' GLU . 0.9 OUTLIER -70.51 -33.73 71.53 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 108.404 -0.962 . . . . 0.82 108.404 178.893 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -77.62 -40.54 41.61 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.34 -0.985 . . . . 1.16 108.34 177.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 3.5 m . . . . . 0 C--O 1.251 1.172 0 CA-C-N 115.768 -0.651 . . . . 1.39 111.221 177.858 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 C--O 1.234 0.251 0 CA-C-O 121.538 0.685 . . . . 1.18 109.781 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -76.36 -35.06 58.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.319 -0.855 . . . . 1.27 109.758 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.604 ' HA ' ' CD2' ' A' ' 16' ' ' PHE . 81.6 mttt -66.21 -28.85 69.06 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.498 0.666 . . . . 0.99 109.427 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.402 ' HB3' ' HZ2' ' B' ' 299' ' ' LYS . 3.8 tp10 -60.0 -36.81 78.0 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.775 -1.102 . . . . 1.29 110.851 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.471 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -64.49 -39.19 93.33 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.939 -0.573 . . . . 0.58 111.011 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.604 ' CD2' ' HA ' ' A' ' 13' ' ' LYS . 9.7 m-85 -65.75 -14.0 60.46 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.704 0.288 . . . . 0.98 111.444 -179.282 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 42.5 m -110.71 -36.03 5.83 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.382 0.512 . . . . 0.73 112.382 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.0 mt -91.93 -22.93 19.77 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.337 0.495 . . . . 0.55 112.337 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.471 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 84.8 t80 -91.55 -50.01 6.0 Favored 'General case' 0 C--N 1.327 -0.38 0 O-C-N 122.353 -0.217 . . . . 0.79 110.622 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -80.46 148.52 30.45 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.384 -0.371 . . . . 0.59 111.099 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -130.61 15.04 5.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.32 -0.4 . . . . 1.57 111.361 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -108.94 -38.34 5.61 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.063 0.459 . . . . 0.82 110.525 -178.666 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 122.64 -13.15 8.75 Favored Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 111.109 -0.797 . . . . 0.87 111.109 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -69.1 -39.52 78.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.424 -0.388 . . . . 0.74 110.986 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 75.18 24.96 69.88 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.873 -0.68 . . . . 1.3 112.903 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.703 HG22 ' HA ' ' A' ' 64' ' ' ASP . 22.5 p -119.7 156.26 30.83 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.935 0.368 . . . . 0.66 110.727 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.594 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 55.7 mt -96.14 108.35 21.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.027 0.441 . . . . 0.5 111.36 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.68 175.9 6.0 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.425 -0.807 . . . . 0.77 109.592 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.474 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -53.43 -41.81 66.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.234 0.54 . . . . 0.59 111.892 179.916 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -58.03 -53.3 59.76 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.343 -0.844 . . . . 0.56 113.269 -178.379 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 18.4 mp0 -75.73 -23.49 56.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.679 0.276 . . . . 0.87 111.716 -177.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.427 HD11 ' CD1' ' B' ' 292' ' ' TRP . 14.4 tp -69.93 -49.98 46.6 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.05 -0.523 . . . . 0.47 109.966 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.585 ' O ' ' HB2' ' A' ' 37' ' ' ARG . . . -71.68 -36.91 61.83 Favored Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 115.47 -0.786 . . . . 0.36 113.634 -178.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.62 -41.23 89.94 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 117.825 0.813 . . . . 0.47 112.232 -178.349 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.405 HG11 ' HB3' ' B' ' 295' ' ' PRO . 72.7 t -71.93 -57.02 8.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.666 0.27 . . . . 1.38 110.918 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 36.3 mtt -58.43 -27.56 64.44 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.396 -0.365 . . . . 0.85 111.517 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.585 ' HB2' ' O ' ' A' ' 33' ' ' GLY . 43.6 ttt180 -62.97 -32.69 74.07 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.986 -0.552 . . . . 1.95 111.158 178.604 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.5 m -94.3 -3.98 49.54 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.955 -0.566 . . . . 0.59 111.373 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.4 tp -95.33 -42.35 8.56 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.251 -0.431 . . . . 0.72 110.858 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 41' ' ' GLN . . . -163.31 38.35 0.33 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.699 -0.763 . . . . 0.56 112.163 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 40' ' ' GLY . 1.2 mp0 71.79 154.01 0.13 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.449 0.642 . . . . 2.83 111.644 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -119.28 139.24 27.32 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.034 -0.53 . . . . 0.96 110.117 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -77.12 -157.76 0.07 OUTLIER 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.312 2.008 . . . . 0.61 113.045 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.0 p -77.73 160.85 28.15 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 122.045 -0.409 . . . . 0.8 111.911 -178.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -54.71 -31.53 58.28 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.744 -0.662 . . . . 2.13 110.865 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.4 -54.22 40.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 0.7 110.597 179.041 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -64.19 -34.02 77.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.746 -0.661 . . . . 0.81 110.515 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.474 ' HG ' HG22 ' A' ' 29' ' ' THR . 46.6 tp -67.71 -41.61 83.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.671 -0.695 . . . . 0.76 110.747 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.498 ' O ' HG22 ' A' ' 52' ' ' ILE . 23.0 tt0 -67.35 -32.23 73.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.169 -0.469 . . . . 1.12 110.144 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -66.87 -32.36 73.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.203 0.525 . . . . 1.42 109.922 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.4 mmm -64.61 -38.78 92.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.425 -0.807 . . . . 0.54 111.276 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.498 HG22 ' O ' ' A' ' 49' ' ' GLN . 6.9 tp -75.89 -12.64 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.152 0.501 . . . . 0.59 110.914 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -85.44 -21.75 28.6 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.932 -0.766 . . . . 1.06 108.932 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.674 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 11.4 tt0 -89.76 16.8 7.37 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.384 -1.28 . . . . 1.58 110.572 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.712 ' HB ' ' HB3' ' B' ' 288' ' ' ALA . 6.6 p -146.82 -38.6 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 120.094 -0.642 . . . . 0.82 112.557 -177.229 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -85.79 98.49 10.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.319 0.58 . . . . 0.7 109.716 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.4 -19.77 29.21 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 113.018 0.747 . . . . 0.9 113.018 -177.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -71.4 -36.62 71.44 Favored 'General case' 0 C--N 1.327 -0.39 0 O-C-N 122.444 -0.16 . . . . 0.85 110.821 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 101.25 49.0 1.37 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.204 -0.998 . . . . 1.03 113.839 178.084 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 27.0 p-10 -135.31 -14.53 1.98 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 117.111 0.456 . . . . 1.61 110.531 178.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 72.69 24.84 75.41 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 121.087 -0.577 . . . . 0.67 112.63 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 18.4 m -155.35 126.72 7.26 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.78 -0.452 . . . . 0.65 109.78 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.485 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.6 OUTLIER -100.47 108.85 23.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 120.456 -0.498 . . . . 0.5 110.479 179.829 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.703 ' HA ' HG22 ' A' ' 26' ' ' THR . 28.5 t0 -83.17 175.04 10.26 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.097 -0.956 . . . . 1.09 110.052 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.448 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 4.5 m-85 -46.17 -53.69 21.25 Favored Pre-proline 0 CA--C 1.544 0.725 0 N-CA-C 112.915 0.709 . . . . 1.78 112.915 -178.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.448 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 19.7 Cg_endo -59.14 -38.56 85.84 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 122.138 1.892 . . . . 0.79 112.866 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -66.53 -40.38 89.1 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.187 0.518 . . . . 0.66 110.257 -179.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -63.38 -36.33 83.35 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.45 -0.795 . . . . 0.77 110.903 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.5 mt -62.34 -23.37 66.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.181 -0.463 . . . . 0.9 111.693 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.11 -40.42 9.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.192 0.52 . . . . 1.02 110.508 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.573 ' HE3' ' HA ' ' B' ' 289' ' ' ALA . 10.9 tpt -54.84 -48.83 72.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.264 -0.88 . . . . 0.69 111.803 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.429 ' SD ' ' HG3' ' A' ' 71' ' ' MET . 0.1 OUTLIER -89.8 22.93 2.9 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 122.241 -0.287 . . . . 0.99 111.77 -179.442 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.09 -41.81 1.11 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.298 0.571 . . . . 1.21 111.454 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? . . . . . 0 C--N 1.321 -0.665 0 CA-C-N 116.016 -0.538 . . . . 2.56 110.829 -179.47 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 287' ' ' ARG . . . . . 0.674 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 1.4 tpm_? . . . . . 0 N--CA 1.479 0.978 0 N-CA-C 110.564 -0.162 . . . . 3.11 110.564 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.712 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -58.44 -30.91 67.28 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 120.801 0.334 . . . . 0.6 111.39 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 289' ' ' ALA . . . . . 0.717 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -70.44 -12.21 61.42 Favored 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 116.05 -0.523 . . . . 0.65 111.316 -178.366 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 290' ' ' ASN . . . . . 0.448 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 14.8 m120 -99.87 -40.86 7.48 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-O 121.76 0.791 . . . . 0.87 110.033 173.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 291' ' ' LEU . . . . . 0.585 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 5.7 mt -66.38 -44.54 82.85 Favored 'General case' 0 C--O 1.206 -1.211 0 CA-C-N 114.77 -1.105 . . . . 1.37 109.42 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.681 ' CE2' HG21 ' A' ' 55' ' ' VAL . 10.3 m0 -56.29 -53.92 58.56 Favored Pre-proline 0 N--CA 1.467 0.411 0 N-CA-C 109.519 -0.549 . . . . 0.42 109.519 177.646 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.717 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 13.1 Cg_exo -47.79 -31.56 15.24 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 122.673 2.248 . . . . 0.54 112.951 175.205 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.571 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 6.0 m -58.05 -65.0 2.11 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-O 118.459 -0.781 . . . . 0.95 110.847 178.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.585 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 86.9 Cg_exo -52.56 -33.75 59.65 Favored 'Trans proline' 0 C--N 1.369 1.65 0 C-N-CA 121.62 1.547 . . . . 0.54 112.884 176.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 10.7 tp -67.09 -38.79 86.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.234 0.54 . . . . 0.56 109.609 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 24.8 ttt -67.47 -38.93 85.15 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.715 -0.846 . . . . 1.79 108.715 178.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 298' ' ' ILE . . . . . 0.482 HG12 ' O ' ' B' ' 294' ' ' SER . 18.3 mm -66.91 -36.2 76.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.021 -0.991 . . . . 0.5 108.689 177.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 299' ' ' LYS . . . . . 0.402 ' HZ2' ' HB3' ' A' ' 14' ' ' GLU . 0.1 OUTLIER -63.75 -35.75 81.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.698 -0.683 . . . . 0.51 109.419 178.199 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 2.4 mmt180 -68.12 -38.4 82.18 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.855 -0.611 . . . . 2.44 109.583 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 28.6 m -69.62 -33.74 73.09 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.54 -0.754 . . . . 0.66 110.401 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -77.11 -32.83 56.83 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.292 -0.632 . . . . 2.44 109.292 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.5 -33.2 74.61 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.705 -0.68 . . . . 0.82 109.202 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -77.88 -35.96 50.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.254 -0.885 . . . . 1.16 109.941 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.5 t . . . . . 0 C--O 1.252 1.201 0 CA-C-O 118.108 -0.949 . . . . 1.39 110.301 179.662 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 . . . . . 0 N--CA 1.453 -0.298 0 CA-C-O 120.908 0.385 . . . . 1.18 110.315 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.1 m-30 -70.93 -37.27 72.88 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.068 -0.514 . . . . 1.27 110.45 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -64.71 -32.99 74.92 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 121.61 0.719 . . . . 0.99 110.046 179.021 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.487 ' HA ' ' OE1' ' A' ' 14' ' ' GLU . 1.4 tp10 -59.64 -32.28 70.29 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.459 -0.791 . . . . 1.29 110.639 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.31 -45.76 86.53 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.147 -0.479 . . . . 0.58 110.738 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -82.1 12.23 4.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.799 0.333 . . . . 0.98 111.808 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.8 m -123.05 -44.27 2.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.365 -0.38 . . . . 0.73 111.019 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.48 ' HB2' ' CG ' ' B' ' 299' ' ' LYS . 92.4 mt -88.98 -31.85 17.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.826 0.346 . . . . 0.55 111.456 -179.329 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -77.54 -56.34 4.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.882 0.372 . . . . 0.79 110.43 -179.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -86.02 140.17 30.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.812 -0.631 . . . . 0.59 110.751 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.3 mptt -119.22 -0.17 11.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.923 -0.581 . . . . 1.57 111.305 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -86.95 -45.07 11.14 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.087 0.47 . . . . 0.82 110.031 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 119.26 -6.66 12.9 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 110.586 -1.006 . . . . 0.87 110.586 -178.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -61.52 -33.52 73.96 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 114.642 -0.779 . . . . 0.74 109.966 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.66 41.97 97.49 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.008 -0.615 . . . . 1.3 112.77 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -141.9 145.85 35.07 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.811 -0.194 . . . . 0.66 110.517 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.491 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 89.9 mt -84.68 106.47 14.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.076 0.465 . . . . 0.5 110.355 178.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.09 178.11 4.75 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.869 -0.605 . . . . 0.77 109.651 179.439 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.52 -35.22 67.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.01 0.433 . . . . 0.59 111.086 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -58.91 -49.08 79.15 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.943 -0.571 . . . . 0.56 112.168 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 54.8 mp0 -81.01 -26.01 36.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.257 0.551 . . . . 0.87 111.335 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.459 HD21 ' CE ' ' A' ' 51' ' ' MET . 20.1 tp -72.35 -32.85 66.83 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.387 -0.824 . . . . 0.47 110.213 -179.629 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -86.74 -33.37 13.06 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.87 -0.681 . . . . 0.36 113.825 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.88 -40.03 79.28 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 112.41 0.522 . . . . 0.47 112.41 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.5 p -70.51 -50.71 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 O-C-N 122.17 -0.331 . . . . 1.38 110.636 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.0 mtt -56.26 -43.74 79.04 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.065 0.46 . . . . 0.85 111.264 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -53.99 -42.01 68.56 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.373 -0.83 . . . . 1.95 111.872 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.8 m -84.17 -18.72 35.74 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.071 -0.513 . . . . 0.59 111.77 -178.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.6 mp -87.85 -53.16 4.9 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 111.894 0.331 . . . . 0.72 111.894 -178.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -150.55 43.19 0.73 Allowed Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.471 -0.871 . . . . 0.56 112.154 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 71.32 155.45 0.15 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.604 0.716 . . . . 2.83 111.344 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -95.61 134.19 24.57 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.728 -0.669 . . . . 0.96 109.91 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.25 -160.46 0.11 Allowed 'Trans proline' 0 C--O 1.23 0.116 0 C-N-CA 122.824 2.35 . . . . 0.61 111.301 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.1 p -83.63 165.17 19.21 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 109.689 -0.486 . . . . 0.8 109.689 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -64.91 -24.13 67.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 2.13 110.199 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.24 -50.87 62.29 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.313 -0.403 . . . . 0.7 110.859 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -68.11 -33.72 75.05 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.317 0.58 . . . . 0.81 110.199 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.5 tp -68.3 -41.36 81.04 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.732 -0.667 . . . . 0.76 111.424 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.481 ' O ' HG22 ' A' ' 52' ' ' ILE . 23.4 tt0 -67.64 -40.78 84.56 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.876 -0.602 . . . . 1.12 110.792 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -72.6 -27.07 61.94 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.576 -0.45 . . . . 1.42 110.706 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.463 ' O ' HG12 ' A' ' 55' ' ' VAL . 1.1 tmm? -62.91 -38.58 91.53 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.494 -0.321 . . . . 0.54 110.48 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.481 HG22 ' O ' ' A' ' 49' ' ' GLN . 10.3 tp -78.76 -15.82 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 CA-C-O 121.368 0.604 . . . . 0.59 110.062 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -83.98 -27.88 28.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.827 0.822 . . . . 1.06 108.872 178.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.438 ' CD ' ' HG3' ' B' ' 287' ' ' ARG . 0.9 OUTLIER -81.54 14.79 2.36 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.977 -1.01 . . . . 1.58 111.0 -179.629 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.685 HG21 ' CE2' ' B' ' 292' ' ' TRP . 1.4 p -144.24 -41.16 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 116.477 -0.328 . . . . 0.82 111.253 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -77.94 92.19 4.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.653 0.739 . . . . 0.7 110.827 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.53 -29.29 68.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.082 -0.963 . . . . 0.9 112.283 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.96 -39.71 87.32 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 121.053 -0.259 . . . . 0.85 110.484 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 95.12 46.99 2.71 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.953 -0.642 . . . . 1.03 113.249 178.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -137.47 -0.76 2.15 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.432 0.634 . . . . 1.61 110.233 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.89 15.5 69.26 Favored Glycine 0 C--N 1.334 0.459 0 CA-C-N 115.57 -0.741 . . . . 0.67 113.191 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.8 m -134.05 133.82 41.63 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 121.377 0.608 . . . . 0.65 111.373 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.641 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.3 OUTLIER -121.19 118.6 56.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.966 -0.561 . . . . 0.5 109.763 178.974 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -99.06 -172.59 2.31 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 123.743 0.652 . . . . 1.09 109.749 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.484 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 0.4 OUTLIER -51.75 -55.32 31.01 Favored Pre-proline 0 N--CA 1.469 0.494 0 CA-C-O 119.088 -0.482 . . . . 1.78 112.121 -179.659 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 6.0 Cg_endo -49.07 -44.61 32.31 Favored 'Trans proline' 0 C--N 1.354 0.816 0 C-N-CA 122.456 2.104 . . . . 0.79 112.48 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -69.34 -47.16 65.2 Favored 'General case' 0 C--O 1.222 -0.348 0 O-C-N 123.881 0.738 . . . . 0.66 110.51 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -59.03 -40.48 85.16 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.049 0.452 . . . . 0.77 111.462 -178.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 97.7 mt -57.23 -35.06 69.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.629 -0.714 . . . . 0.9 111.272 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -87.24 -37.82 16.9 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.279 -0.419 . . . . 1.02 110.903 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.583 ' HE3' ' HA ' ' B' ' 289' ' ' ALA . 11.1 tpt -59.1 -46.97 86.95 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.905 -0.589 . . . . 0.69 111.639 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.69 29.43 1.16 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.666 -0.243 . . . . 0.99 111.267 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -136.46 -49.63 0.66 Allowed 'General case' 0 C--O 1.237 0.415 0 CA-C-O 120.842 0.353 . . . . 1.21 110.357 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.064 -0.516 . . . . 2.56 109.842 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 287' ' ' ARG . . . . . 0.438 ' HG3' ' CD ' ' A' ' 54' ' ' GLU . 8.4 ttt-85 . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 109.353 -0.61 . . . . 3.11 109.353 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.539 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -59.88 -23.77 63.72 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.049 0.452 . . . . 0.6 111.559 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 289' ' ' ALA . . . . . 0.693 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -67.43 -11.81 58.71 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-O 119.02 -0.514 . . . . 0.65 109.655 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -99.9 -35.32 9.79 Favored 'General case' 0 C--O 1.246 0.915 0 CA-C-O 121.473 0.654 . . . . 0.87 111.086 174.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 291' ' ' LEU . . . . . 0.495 ' O ' ' HG2' ' B' ' 295' ' ' PRO . 7.1 mp -79.73 -8.08 59.02 Favored 'General case' 0 C--O 1.213 -0.868 0 C-N-CA 123.878 0.871 . . . . 1.37 110.416 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.685 ' CE2' HG21 ' A' ' 55' ' ' VAL . 6.1 m0 -92.45 -55.1 0.25 Allowed Pre-proline 0 C--N 1.318 -0.792 0 N-CA-C 108.062 -1.088 . . . . 0.42 108.062 174.044 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.693 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 9.8 Cg_exo -48.51 -38.63 35.92 Favored 'Trans proline' 0 C--N 1.36 1.133 0 C-N-CA 123.337 2.691 . . . . 0.54 112.707 175.737 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.497 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 5.6 t -61.53 -62.58 5.62 Favored Pre-proline 0 CA--C 1.546 0.817 0 N-CA-C 108.616 -0.883 . . . . 0.95 108.616 178.108 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.497 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 1.0 OUTLIER -46.25 -40.18 21.67 Favored 'Trans proline' 0 C--N 1.361 1.192 0 C-N-CA 123.156 2.571 . . . . 0.54 113.343 174.745 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 13.5 tp -68.86 -37.39 79.07 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.049 0.452 . . . . 0.56 109.968 178.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 27.2 ttt -63.61 -37.6 87.95 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.614 -0.884 . . . . 1.79 108.614 178.108 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 34.3 mm -62.75 -41.21 91.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.113 -0.949 . . . . 0.5 109.073 177.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 299' ' ' LYS . . . . . 0.48 ' CG ' ' HB2' ' A' ' 18' ' ' LEU . 0.2 OUTLIER -62.45 -43.75 98.06 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.452 -0.795 . . . . 0.51 109.753 179.182 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -64.06 -33.98 76.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.295 0.569 . . . . 2.44 110.419 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 39.5 m -69.98 -34.72 73.73 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.621 -0.718 . . . . 0.66 109.245 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -75.98 -28.61 57.93 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 109.423 -0.584 . . . . 2.44 109.423 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -69.97 -35.42 74.45 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.691 -0.855 . . . . 0.82 108.691 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -76.14 -40.02 53.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.189 -0.914 . . . . 1.16 109.104 178.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 6.9 m . . . . . 0 C--O 1.247 0.935 0 CA-C-N 114.848 -1.069 . . . . 1.39 111.763 178.692 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 . . . . . 0 C--O 1.235 0.318 0 CA-C-O 120.972 0.415 . . . . 1.18 110.518 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 18.6 m-30 -75.94 -40.31 54.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.698 -0.683 . . . . 1.27 109.3 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -64.79 -26.48 68.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.211 -0.904 . . . . 0.99 109.969 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.433 ' HG2' ' HE3' ' B' ' 299' ' ' LYS . 1.8 tp10 -67.37 -23.85 65.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.456 -0.793 . . . . 1.29 110.171 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.654 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -74.35 -37.54 63.49 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 109.793 -0.447 . . . . 0.58 109.793 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -75.26 -2.02 26.14 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.557 -0.457 . . . . 0.98 110.512 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -112.6 -53.56 2.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.965 0.412 . . . . 0.73 111.474 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.445 HD12 ' HG2' ' B' ' 299' ' ' LYS . 74.1 mt -85.76 -42.34 14.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.243 -0.435 . . . . 0.55 111.7 -179.083 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.654 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 82.6 t80 -75.06 -35.31 61.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.304 -0.407 . . . . 0.79 111.259 -177.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -91.96 130.58 37.68 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.844 -0.428 . . . . 0.59 109.844 179.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.472 ' HZ1' HG23 ' A' ' 35' ' ' VAL . 6.1 mptt -106.14 -9.65 16.84 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.439 0.533 . . . . 1.57 112.439 -178.145 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.67 -35.56 14.13 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 111.688 0.255 . . . . 0.82 111.688 -178.076 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.06 0.76 33.75 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 121.184 -0.531 . . . . 0.87 111.815 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -81.33 -27.98 34.73 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.812 0.339 . . . . 0.74 110.576 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.06 -46.07 3.59 Favored Glycine 0 CA--C 1.518 0.249 0 C-N-CA 121.318 -0.468 . . . . 1.3 113.475 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -53.27 123.72 12.65 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.522 0.564 . . . . 0.66 112.522 -179.045 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.575 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 18.0 mt -69.83 119.28 15.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-N 116.254 -0.43 . . . . 0.5 111.32 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.26 168.66 14.44 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 108.9 -0.778 . . . . 0.77 108.9 178.485 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.78 -33.78 64.68 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.817 0.341 . . . . 0.59 111.709 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -60.47 -45.44 93.72 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.353 0.501 . . . . 0.56 112.353 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.4 mp0 -80.37 -23.21 40.62 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-O 121.216 0.531 . . . . 0.87 111.688 -178.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.0 tp -72.06 -50.74 25.86 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.851 -0.613 . . . . 0.47 110.167 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.09 -36.13 79.8 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.787 -0.642 . . . . 0.36 113.939 -179.005 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -55.7 -32.71 63.54 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 117.677 0.738 . . . . 0.47 112.385 -178.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.472 HG23 ' HZ1' ' A' ' 21' ' ' LYS . 99.0 t -77.53 -51.61 17.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.233 -0.587 . . . . 1.38 109.955 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 52.6 mtt -59.0 -32.81 70.02 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.924 -0.58 . . . . 0.85 111.841 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.1 ttt180 -58.43 -40.45 82.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.45 -0.341 . . . . 1.95 111.789 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.1 m -97.29 -6.65 33.92 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.112 0.482 . . . . 0.59 110.645 -178.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 16.2 tp -87.06 -47.74 8.67 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.911 -0.586 . . . . 0.72 110.167 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -161.48 47.47 0.37 Allowed Glycine 0 C--N 1.335 0.479 0 C-N-CA 120.45 -0.881 . . . . 0.56 112.634 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 69.98 140.23 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.508 0.671 . . . . 2.83 111.476 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -99.36 136.51 20.4 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.029 -0.532 . . . . 0.96 110.587 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.61 -163.74 0.22 Allowed 'Trans proline' 0 C--O 1.24 0.575 0 C-N-CA 122.898 2.398 . . . . 0.61 112.063 179.099 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 73.0 p -73.64 163.9 27.38 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.355 -0.609 . . . . 0.8 109.355 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -68.18 -29.13 67.92 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.914 0.387 . . . . 2.13 110.181 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.37 -49.76 72.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.946 -0.57 . . . . 0.7 110.422 178.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -63.54 -35.42 80.44 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.909 -0.587 . . . . 0.81 110.644 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.0 tp -70.07 -34.55 73.33 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.949 -0.569 . . . . 0.76 110.182 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.506 ' O ' HG22 ' A' ' 52' ' ' ILE . 15.8 tt0 -68.11 -39.91 82.67 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.545 -0.539 . . . . 1.12 109.545 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -61.02 -29.84 69.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.557 0.694 . . . . 1.42 109.722 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.0 mmm -65.43 -43.27 90.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.353 -0.84 . . . . 0.54 111.946 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.506 HG22 ' O ' ' A' ' 49' ' ' GLN . 4.8 tp -71.73 -18.33 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 CA-C-O 120.985 0.422 . . . . 0.59 111.355 -178.748 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -81.06 -25.02 37.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.625 0.726 . . . . 1.06 110.577 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.413 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 13.1 tt0 -93.51 8.26 41.35 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.325 -0.852 . . . . 1.58 111.046 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.795 ' HB ' ' HB3' ' B' ' 288' ' ' ALA . 8.5 p -142.85 25.86 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.806 0.812 . . . . 0.82 112.701 -177.032 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -146.65 95.53 2.61 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.683 0.754 . . . . 0.7 109.709 178.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.24 -29.98 70.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.334 -0.848 . . . . 0.9 112.047 -178.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.48 -16.02 62.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.998 0.428 . . . . 0.85 111.068 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.77 41.73 95.56 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 121.147 -0.549 . . . . 1.03 113.669 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -120.7 -19.96 7.21 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.955 0.407 . . . . 1.61 110.587 179.189 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 86.12 27.89 29.76 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 115.89 -0.595 . . . . 0.67 112.578 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.3 m -154.78 142.88 20.24 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 121.365 0.602 . . . . 0.65 110.963 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.518 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 1.4 mt -123.35 113.71 38.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.696 -0.684 . . . . 0.5 109.787 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -87.06 -171.0 3.3 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.455 -0.793 . . . . 1.09 110.285 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.504 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 3.9 m-85 -58.48 -53.4 66.53 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 116.004 -0.544 . . . . 1.78 111.536 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.504 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.6 Cg_endo -55.17 -38.69 93.44 Favored 'Trans proline' 0 C--N 1.361 1.214 0 C-N-CA 122.274 1.982 . . . . 0.79 112.85 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.518 ' HB2' HG23 ' A' ' 63' ' ' ILE . 38.2 mt-10 -68.38 -44.94 74.05 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.222 0.534 . . . . 0.66 111.154 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -58.2 -29.77 65.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.235 -0.893 . . . . 0.77 112.135 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 80.4 mt -61.82 -27.3 68.67 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-N 116.41 -0.359 . . . . 0.9 111.427 179.653 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -106.62 -26.92 11.15 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.894 -0.322 . . . . 1.02 111.215 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.615 ' HG3' ' SD ' ' A' ' 72' ' ' MET . 10.5 tpt -49.82 -52.02 35.42 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.298 0.481 . . . . 0.69 112.298 -179.264 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.615 ' SD ' ' HG3' ' A' ' 71' ' ' MET . 0.3 OUTLIER -94.04 17.65 12.04 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.274 0.472 . . . . 0.99 112.274 -178.83 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -110.39 -41.57 4.34 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.885 0.374 . . . . 1.21 111.21 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? . . . . . 0 C--N 1.325 -0.481 0 N-CA-C 109.917 -0.401 . . . . 2.56 109.917 -179.539 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 287' ' ' ARG . . . . . 0.435 HH11 ' HD2' ' B' ' 287' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 110.02 -0.363 . . . . 3.11 110.02 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.795 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -58.58 -24.15 60.23 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-O 120.99 0.424 . . . . 0.6 110.517 178.584 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 289' ' ' ALA . . . . . 0.57 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -68.97 -14.54 63.1 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 115.733 -0.667 . . . . 0.65 111.002 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 290' ' ' ASN . . . . . 0.4 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 6.5 m120 -96.14 -39.88 9.48 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 109.092 -0.707 . . . . 0.87 109.092 175.211 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 291' ' ' LEU . . . . . 0.78 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 1.2 mp -64.53 -42.54 95.69 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 115.212 -0.903 . . . . 1.37 109.385 178.612 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.575 ' CZ3' HD12 ' A' ' 27' ' ' ILE . 4.4 m0 -56.56 -57.28 24.49 Favored Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 108.307 -0.998 . . . . 0.42 108.307 177.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.57 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 7.0 Cg_exo -50.06 -24.71 11.41 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.844 2.362 . . . . 0.54 113.759 175.101 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.499 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 50.6 m -60.44 -68.39 0.79 Allowed Pre-proline 0 CA--C 1.544 0.715 0 CA-C-O 118.484 -0.769 . . . . 0.95 109.585 178.142 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.78 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 69.6 Cg_exo -48.88 -38.32 38.09 Favored 'Trans proline' 0 C--N 1.371 1.72 0 C-N-CA 121.88 1.72 . . . . 0.54 112.629 175.094 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 296' ' ' LEU . . . . . 0.516 ' O ' ' HG3' ' B' ' 300' ' ' ARG . 19.6 tp -61.39 -37.93 85.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.161 -0.472 . . . . 0.56 110.011 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 6.2 ttt -67.16 -39.69 86.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.818 -0.628 . . . . 1.79 109.46 178.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 43.6 mm -64.73 -39.63 86.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.646 0.736 . . . . 0.5 109.057 178.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 299' ' ' LYS . . . . . 0.523 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.1 OUTLIER -62.68 -40.84 98.36 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.905 -1.043 . . . . 0.51 109.119 178.011 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 300' ' ' ARG . . . . . 0.516 ' HG3' ' O ' ' B' ' 296' ' ' LEU . 30.3 mtp180 -63.29 -44.79 94.05 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.734 -0.666 . . . . 2.44 109.898 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 50.7 m -59.95 -37.83 80.69 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.71 -0.677 . . . . 0.66 110.109 178.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.2 tptp -73.25 -38.31 66.03 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 110.09 -0.337 . . . . 2.44 110.09 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -64.83 -28.48 69.58 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.603 0.716 . . . . 0.82 109.638 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -81.46 -30.99 33.2 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.142 -0.935 . . . . 1.16 109.636 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 13.0 m . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.304 -0.855 . . . . 1.39 112.294 179.112 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.233 0.209 0 CA-C-O 121.04 0.448 . . . . 1.18 110.475 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -76.51 -32.08 58.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.98 -0.555 . . . . 1.27 110.032 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -72.09 -15.45 62.01 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.171 0.51 . . . . 0.99 110.679 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.417 ' HG3' ' CD1' ' A' ' 18' ' ' LEU . 3.0 tp10 -72.45 -26.05 61.68 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.907 -0.588 . . . . 1.29 110.386 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.588 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -66.73 -43.09 85.12 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.163 -0.471 . . . . 0.58 110.78 -178.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -80.65 5.32 15.89 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.367 -0.379 . . . . 0.98 110.871 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.3 m -112.74 -41.28 3.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.73 112.075 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.634 HD12 ' HG2' ' B' ' 299' ' ' LYS . 18.2 mt -103.49 -44.15 5.2 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.438 0.532 . . . . 0.55 112.438 -178.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.588 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 83.1 t80 -62.59 -34.23 76.58 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.247 0.546 . . . . 0.79 110.435 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -93.95 138.63 31.86 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.688 -0.687 . . . . 0.59 110.139 178.592 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -124.52 32.62 5.43 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.257 -0.277 . . . . 1.57 110.989 -179.049 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -131.61 -31.14 1.59 Allowed 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.641 -0.424 . . . . 0.82 111.195 -179.207 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.73 18.65 17.6 Favored Glycine 0 CA--C 1.505 -0.562 0 N-CA-C 111.045 -0.822 . . . . 0.87 111.045 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -97.36 -32.17 12.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.294 -0.453 . . . . 0.74 110.596 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 69.13 31.6 72.2 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 120.922 -0.656 . . . . 1.3 113.707 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.82 138.07 53.29 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 117.909 0.854 . . . . 0.66 110.675 179.17 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 28.6 mt -81.8 111.46 18.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-O 121.089 0.471 . . . . 0.5 111.219 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -128.11 170.18 13.23 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.353 -0.84 . . . . 0.77 109.319 178.458 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.84 -31.74 59.8 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.18 0.514 . . . . 0.59 112.217 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.2 tttt -62.11 -45.53 93.06 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.273 0.559 . . . . 0.56 112.212 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.5 mp0 -79.22 -20.95 47.0 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.896 -0.593 . . . . 0.87 111.162 -178.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.414 HD21 ' CE ' ' A' ' 51' ' ' MET . 23.5 tp -80.0 -47.39 15.01 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.428 -0.806 . . . . 0.47 110.602 -179.514 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.14 -37.12 72.34 Favored Glycine 0 CA--C 1.512 -0.145 0 CA-C-N 115.429 -0.805 . . . . 0.36 113.289 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 p -57.12 -28.1 62.39 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.983 0.392 . . . . 0.47 111.89 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 93.5 t -77.07 -56.28 8.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 120.881 -0.328 . . . . 1.38 110.616 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 51.3 mtt -57.69 -37.72 73.95 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.447 -0.342 . . . . 0.85 110.872 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -55.12 -42.18 72.64 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.755 -0.657 . . . . 1.95 111.366 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.8 m -89.58 -19.48 24.92 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.842 0.354 . . . . 0.59 111.786 -178.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.3 tp -79.9 -36.87 35.82 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 112.14 0.422 . . . . 0.72 112.14 -179.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.13 43.81 0.14 Allowed Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.702 -0.761 . . . . 0.56 112.454 -178.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 70.85 147.49 0.07 Allowed 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.77 0.795 . . . . 2.83 111.936 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -102.64 134.8 19.69 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.644 -0.707 . . . . 0.96 109.819 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.7 -161.2 0.11 Allowed 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.475 2.117 . . . . 0.61 112.514 179.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.5 p -76.43 162.16 28.08 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.535 -0.302 . . . . 0.8 110.319 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.431 ' CD ' ' H ' ' A' ' 45' ' ' GLU . 2.9 mp0 -61.92 -31.03 71.31 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 116.676 -0.238 . . . . 2.13 111.199 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.72 -49.21 77.37 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.144 0.497 . . . . 0.7 110.312 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -66.52 -35.12 79.47 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.054 -0.521 . . . . 0.81 110.877 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 21.2 tp -71.61 -34.54 69.94 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.642 -0.708 . . . . 0.76 111.217 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.404 ' O ' HG22 ' A' ' 52' ' ' ILE . 21.4 tt0 -71.55 -39.28 70.78 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.697 -0.483 . . . . 1.12 109.697 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -60.04 -32.38 70.85 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.562 -0.745 . . . . 1.42 109.909 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.414 ' CE ' HD21 ' A' ' 32' ' ' LEU . 1.8 mmm -62.22 -45.98 90.94 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.196 -0.911 . . . . 0.54 110.66 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.638 ' HA ' HG12 ' A' ' 55' ' ' VAL . 6.1 tp -75.98 -18.49 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 C-N-CA 120.71 -0.396 . . . . 0.59 111.41 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -78.96 -20.09 50.05 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.298 0.571 . . . . 1.06 110.269 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.502 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 14.4 tt0 -99.08 9.5 43.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.564 -0.744 . . . . 1.58 111.706 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.769 ' HB ' ' CB ' ' B' ' 288' ' ' ALA . 9.5 p -137.6 -13.07 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-O 121.227 0.537 . . . . 0.82 112.34 -176.852 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -109.49 98.48 7.86 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.74 -0.837 . . . . 0.7 108.74 178.164 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.0 -22.18 61.46 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 115.957 -0.565 . . . . 0.9 111.936 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.42 -24.28 57.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.155 0.502 . . . . 0.85 110.529 178.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 75.8 29.04 59.87 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.926 -0.654 . . . . 1.03 113.219 178.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -108.05 -22.17 12.51 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.137 -0.69 . . . . 1.61 109.137 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.99 -2.71 64.14 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.846 -0.693 . . . . 0.67 113.526 178.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.3 m -128.13 153.51 46.78 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-O 121.289 0.566 . . . . 0.65 111.526 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.612 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.5 OUTLIER -132.57 122.76 48.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.628 -0.715 . . . . 0.5 110.317 179.515 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -96.11 -171.17 2.26 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 123.709 0.631 . . . . 1.09 110.503 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.516 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 4.8 m-85 -54.18 -55.09 40.39 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 123.801 0.84 . . . . 1.78 111.422 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 10.1 Cg_endo -53.33 -42.68 63.45 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 122.937 2.425 . . . . 0.79 111.845 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.444 ' OE2' HG12 ' A' ' 63' ' ' ILE . 23.5 mt-10 -65.47 -48.94 70.95 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.216 -0.902 . . . . 0.66 109.68 178.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -56.67 -43.93 80.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.316 0.579 . . . . 0.77 110.367 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.4 mt -55.56 -31.86 62.52 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.177 -0.92 . . . . 0.9 111.72 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.3 m -94.61 -38.28 10.93 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.921 0.391 . . . . 1.02 111.263 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.437 ' HE1' HG23 ' A' ' 55' ' ' VAL . 12.4 tpt -61.26 -59.24 5.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.992 -0.549 . . . . 0.69 111.937 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.405 ' SD ' ' HG3' ' A' ' 71' ' ' MET . 0.1 OUTLIER -77.93 31.98 0.17 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.4 -0.364 . . . . 0.99 111.437 -179.064 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.407 ' H ' ' C ' ' A' ' 71' ' ' MET . . . -136.69 -22.32 1.25 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.171 -0.468 . . . . 1.21 111.604 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? . . . . . 0 C--N 1.328 -0.368 0 CA-C-O 121.255 0.55 . . . . 2.56 111.437 -179.18 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 287' ' ' ARG . . . . . 0.502 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 120.906 0.384 . . . . 3.11 110.146 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.769 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -57.86 -25.01 60.14 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 116.12 -0.491 . . . . 0.6 112.3 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 289' ' ' ALA . . . . . 0.4 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -69.94 -1.72 10.42 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 113.24 0.83 . . . . 0.65 113.24 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 290' ' ' ASN . . . . . 0.472 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 7.3 m120 -112.11 -30.77 7.11 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.303 0.573 . . . . 0.87 109.477 176.409 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 291' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' B' ' 291' ' ' LEU . 33.0 mt -80.92 -6.02 58.17 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 114.879 -1.055 . . . . 1.37 109.809 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.612 ' CH2' HD12 ' A' ' 63' ' ' ILE . 1.7 m0 -92.13 -53.23 0.27 Allowed Pre-proline 0 CA--C 1.543 0.7 0 N-CA-C 107.589 -1.263 . . . . 0.42 107.589 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.472 ' HD2' ' C ' ' B' ' 290' ' ' ASN . 13.3 Cg_exo -51.68 -36.3 60.84 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 123.05 2.5 . . . . 0.54 112.921 175.193 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.493 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 2.7 t -58.98 -61.45 7.79 Favored Pre-proline 0 CA--C 1.548 0.885 0 CA-C-O 119.282 -0.389 . . . . 0.95 111.063 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.493 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 88.4 Cg_exo -53.12 -33.09 62.23 Favored 'Trans proline' 0 C--N 1.358 1.058 0 C-N-CA 122.691 2.261 . . . . 0.54 112.596 178.191 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 15.5 tp -68.02 -35.37 78.18 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.126 0.489 . . . . 0.56 110.091 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 16.7 ttt -70.34 -38.43 74.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.23 -0.896 . . . . 1.79 108.699 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 298' ' ' ILE . . . . . 0.407 HG12 ' O ' ' B' ' 294' ' ' SER . 48.9 mm -61.74 -38.37 80.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 108.211 -1.033 . . . . 0.5 108.211 177.089 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 299' ' ' LYS . . . . . 0.634 ' HG2' HD12 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -59.99 -39.97 87.56 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.308 -0.627 . . . . 0.51 109.308 177.451 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -64.89 -41.15 95.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.55 -0.75 . . . . 2.44 110.414 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 19.4 m -63.45 -35.88 81.91 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.738 -0.664 . . . . 0.66 109.595 178.199 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 14.3 tptp -76.28 -30.21 57.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.066 -0.515 . . . . 2.44 109.736 179.085 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 9.4 tttp -68.71 -34.58 75.88 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.806 -0.812 . . . . 0.82 108.806 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -76.01 -40.34 53.78 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.568 -1.196 . . . . 1.16 110.08 179.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.668 -0.682 . . . . 1.39 111.455 179.575 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 . . . . . 0 C--O 1.236 0.343 0 CA-C-O 120.866 0.365 . . . . 1.18 111.32 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -80.46 -37.54 31.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.145 0.498 . . . . 1.27 109.802 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -61.64 -22.69 65.49 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.507 0.67 . . . . 0.99 111.206 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.504 ' CG ' ' HE3' ' B' ' 299' ' ' LYS . 1.3 tp10 -70.88 -22.0 62.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.387 -0.824 . . . . 1.29 112.076 -177.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.697 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -70.18 -36.31 74.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.181 0.515 . . . . 0.58 110.647 179.034 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.422 ' HB3' ' HA3' ' A' ' 25' ' ' GLY . 10.5 m-85 -86.19 16.55 4.25 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.022 -0.535 . . . . 0.98 109.665 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.6 m -125.56 -56.58 1.49 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.886 -0.597 . . . . 0.73 112.202 -178.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.494 ' HB2' ' CG ' ' B' ' 299' ' ' LYS . 13.6 mt -96.1 -30.56 13.47 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.255 0.465 . . . . 0.55 112.255 -178.108 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.697 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 46.5 t80 -73.92 -34.03 64.2 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.062 0.458 . . . . 0.79 110.096 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -91.22 140.69 29.56 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.685 -0.689 . . . . 0.59 109.605 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -114.74 6.55 15.63 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.579 0.585 . . . . 1.57 112.579 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.62 -53.86 2.62 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.419 -0.512 . . . . 0.82 110.942 -178.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 139.44 4.38 1.46 Allowed Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.827 -0.701 . . . . 0.87 112.34 -178.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.93 -58.15 2.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.974 0.416 . . . . 0.74 110.017 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.422 ' HA3' ' HB3' ' A' ' 16' ' ' PHE . . . 111.84 -29.95 8.13 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.798 -0.637 . . . . 1.3 111.556 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.85 130.22 40.28 Favored 'General case' 0 C--N 1.323 -0.549 0 O-C-N 123.925 0.427 . . . . 0.66 111.859 -179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.579 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 24.1 mt -78.79 108.45 12.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 116.107 -0.497 . . . . 0.5 110.615 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.91 170.9 9.34 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 108.49 -0.93 . . . . 0.77 108.49 177.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.473 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -57.58 -31.69 66.42 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 111.679 0.252 . . . . 0.59 111.679 -179.54 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.9 tttt -63.8 -44.96 91.76 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.066 0.395 . . . . 0.56 112.066 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 25.2 mp0 -79.97 -21.81 43.31 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 111.742 0.275 . . . . 0.87 111.742 -178.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.593 HD21 ' HE2' ' A' ' 51' ' ' MET . 18.1 tp -79.53 -46.62 17.01 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.083 -0.508 . . . . 0.47 110.77 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.82 -36.32 86.74 Favored Glycine 0 N--CA 1.453 -0.212 0 CA-C-N 115.851 -0.613 . . . . 0.36 113.104 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.71 -31.05 67.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.771 0.286 . . . . 0.47 111.351 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 67.0 t -73.23 -56.55 9.18 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 N-CA-C 109.265 -0.643 . . . . 1.38 109.265 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 59.9 mtt -52.15 -46.9 65.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.121 -0.945 . . . . 0.85 111.134 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -57.28 -38.02 73.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.433 -0.803 . . . . 1.95 111.3 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.0 m -95.41 14.18 23.42 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.102 -0.499 . . . . 0.59 111.671 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.8 tp -122.03 -43.1 2.35 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.536 0.208 . . . . 0.72 110.916 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -164.24 49.93 0.29 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.618 -0.801 . . . . 0.56 112.599 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 72.35 146.07 0.08 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.517 0.727 . . . . 2.83 111.707 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -87.2 140.55 32.44 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.453 -0.794 . . . . 0.96 109.88 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -77.91 -172.96 1.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.271 1.981 . . . . 0.61 111.388 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.7 p -81.76 160.33 23.63 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.935 -0.765 . . . . 0.8 108.935 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -55.16 -32.92 62.52 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.059 0.392 . . . . 2.13 112.059 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.41 -52.34 58.68 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.224 -0.444 . . . . 0.7 110.829 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -64.01 -34.03 77.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.439 . . . . 0.81 110.839 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.473 ' HG ' HG22 ' A' ' 29' ' ' THR . 15.3 tp -63.73 -47.15 82.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.256 -0.429 . . . . 0.76 110.346 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -69.97 -33.39 72.02 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 116.353 -0.385 . . . . 1.12 111.459 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -71.78 -26.8 62.58 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.318 0.58 . . . . 1.42 110.157 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.593 ' HE2' HD21 ' A' ' 32' ' ' LEU . 1.8 mmm -61.95 -42.25 98.9 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.462 -0.79 . . . . 0.54 110.859 178.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.471 ' HA ' HG12 ' A' ' 55' ' ' VAL . 5.4 tp -76.87 -14.67 14.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-O 121.164 0.507 . . . . 0.59 110.278 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.5 t30 -78.37 -22.15 48.35 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.686 0.755 . . . . 1.06 109.054 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.622 ' OE2' ' HA ' ' B' ' 287' ' ' ARG . 2.4 tt0 -98.25 22.52 9.47 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.417 -0.811 . . . . 1.58 111.047 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.741 ' HB ' ' CB ' ' B' ' 288' ' ' ALA . 9.1 p -154.07 -36.65 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.205 0 N-CA-C 113.627 0.973 . . . . 0.82 113.627 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -89.77 91.18 8.53 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.243 -0.583 . . . . 0.7 109.524 179.089 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.36 -24.91 67.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.197 -0.91 . . . . 0.9 113.364 -178.128 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -75.58 -10.95 59.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.93 0.395 . . . . 0.85 110.66 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.08 48.59 68.98 Favored Glycine 0 CA--C 1.519 0.312 0 CA-C-N 116.077 -0.51 . . . . 1.03 114.128 178.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -128.87 -27.79 2.5 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.198 0.523 . . . . 1.61 110.027 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.73 17.88 36.97 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.78 -0.645 . . . . 0.67 113.2 178.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 2.0 m -141.75 139.99 32.98 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.886 0.343 . . . . 0.65 110.808 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.669 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.9 OUTLIER -124.56 118.92 54.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.119 0.485 . . . . 0.5 111.202 179.879 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -93.01 -167.14 1.67 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.368 -0.833 . . . . 1.09 110.472 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.48 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 28.3 m-85 -57.97 -53.32 67.0 Favored Pre-proline 0 CA--C 1.54 0.592 0 C-N-CA 122.936 0.494 . . . . 1.78 112.292 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.3 Cg_endo -57.53 -36.44 98.66 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.991 1.794 . . . . 0.79 112.026 179.353 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.401 ' HB2' HG23 ' A' ' 63' ' ' ILE . 31.1 mt-10 -72.14 -39.48 68.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.526 -0.761 . . . . 0.66 110.943 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -66.12 -37.47 85.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.245 -0.434 . . . . 0.77 109.835 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.606 ' O ' ' HB3' ' A' ' 73' ' ' ALA . 35.8 mt -63.71 -32.64 74.2 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.817 -0.629 . . . . 0.9 110.286 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.5 m -92.31 11.07 27.13 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.95 -0.568 . . . . 1.02 110.644 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.7 tpt -119.15 -68.25 0.93 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.369 -0.378 . . . . 0.69 111.181 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -17.68 63.39 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.735 0.303 . . . . 0.99 111.727 -178.454 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.606 ' HB3' ' O ' ' A' ' 69' ' ' LEU . . . -104.06 9.47 36.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.918 0.39 . . . . 1.21 110.459 179.003 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.235 0.319 0 CA-C-N 116.27 -0.423 . . . . 2.56 111.833 -178.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 287' ' ' ARG . . . . . 0.622 ' HA ' ' OE2' ' A' ' 54' ' ' GLU . 1.7 tpm_? . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 109.441 -0.578 . . . . 3.11 109.441 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.741 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -61.4 -28.16 69.05 Favored 'General case' 0 C--O 1.214 -0.815 0 N-CA-C 113.295 0.85 . . . . 0.6 113.295 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 289' ' ' ALA . . . . . 0.548 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -70.59 1.3 5.36 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.03 0.752 . . . . 0.65 113.03 -179.343 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -115.95 -37.28 3.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 122.847 1.308 . . . . 0.87 109.431 176.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 25.6 mt -80.52 -7.14 59.09 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 113.245 -1.798 . . . . 1.37 110.662 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.682 ' CE2' HG21 ' A' ' 55' ' ' VAL . 5.0 m0 -93.81 -53.88 0.24 Allowed Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 107.355 -1.35 . . . . 0.42 107.355 174.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.548 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 21.5 Cg_exo -50.94 -37.11 55.58 Favored 'Trans proline' 0 C--N 1.367 1.508 0 C-N-CA 122.578 2.185 . . . . 0.54 113.029 175.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 294' ' ' SER . . . . . . . . . . . . . 1.4 t -59.67 -60.82 9.34 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-O 119.34 -0.362 . . . . 0.95 110.346 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.407 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 85.2 Cg_exo -51.14 -38.4 60.36 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 122.203 1.935 . . . . 0.54 112.091 176.317 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 9.5 tp -64.65 -36.73 85.21 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.824 0.345 . . . . 0.56 110.345 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 17.5 ttt -66.43 -41.66 88.87 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.499 0.666 . . . . 1.79 109.285 177.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 20.4 mm -62.93 -35.6 72.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 108.447 -0.946 . . . . 0.5 108.447 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 299' ' ' LYS . . . . . 0.504 ' HE3' ' CG ' ' A' ' 14' ' ' GLU . 0.2 OUTLIER -66.35 -40.86 90.08 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.88 -1.054 . . . . 0.51 109.381 178.08 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 73.1 mtt180 -63.34 -40.01 96.11 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.198 -0.455 . . . . 2.44 110.101 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 66.2 m -64.71 -42.78 95.01 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.842 -0.617 . . . . 0.66 109.782 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -69.06 -36.9 78.18 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.119 -0.491 . . . . 2.44 110.561 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 3.3 tttp -63.81 -33.08 74.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.815 0.817 . . . . 0.82 109.197 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -81.61 -21.76 38.1 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.699 -1.137 . . . . 1.16 110.81 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.251 1.161 0 CA-C-O 118.575 -0.726 . . . . 1.39 110.265 179.083 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 . . . . . 0 N--CA 1.464 0.237 0 CA-C-O 120.984 0.421 . . . . 1.18 111.265 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -82.45 -38.4 24.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 1.27 110.445 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.419 ' HA ' ' CE2' ' A' ' 16' ' ' PHE . 38.2 mtmt -69.62 -13.9 62.55 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.372 0.606 . . . . 0.99 110.335 179.049 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -73.19 -17.06 61.4 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.277 -0.874 . . . . 1.29 110.696 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.638 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -69.9 -32.82 71.34 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.341 0.591 . . . . 0.58 110.377 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.419 ' CE2' ' HA ' ' A' ' 13' ' ' LYS . 12.6 m-85 -79.92 5.33 14.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.856 -0.611 . . . . 0.98 111.505 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -124.94 -47.56 1.79 Allowed 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 121.049 -0.261 . . . . 0.73 110.99 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.417 ' HB2' ' CG ' ' B' ' 299' ' ' LYS . 35.8 mt -93.22 -38.96 11.27 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 111.866 0.321 . . . . 0.55 111.866 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.638 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 92.0 t80 -74.4 -42.15 59.73 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.861 0.362 . . . . 0.79 110.898 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -87.31 136.56 32.89 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.286 -0.416 . . . . 0.59 110.671 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -106.35 -11.63 15.92 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.145 0.424 . . . . 1.57 112.145 -178.297 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.87 -40.76 11.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.155 0.502 . . . . 0.82 110.655 -179.114 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.07 16.72 15.82 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 110.922 -0.871 . . . . 0.87 110.922 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -96.86 -21.42 17.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.892 0.377 . . . . 0.74 111.02 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.8 -46.11 3.41 Favored Glycine 0 C--O 1.227 -0.291 0 C-N-CA 121.085 -0.579 . . . . 1.3 114.269 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.39 129.84 29.64 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 117.046 0.423 . . . . 0.66 111.622 -179.188 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.405 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 54.4 mt -83.73 115.79 26.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-O 121.362 0.601 . . . . 0.5 111.838 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -126.49 171.86 10.7 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 114.884 -1.053 . . . . 0.77 109.861 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.509 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -57.09 -27.68 61.97 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.742 0.645 . . . . 0.59 112.742 179.405 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -68.1 -39.09 82.91 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.173 0.435 . . . . 0.56 112.173 -178.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 -84.92 -19.22 32.56 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 121.957 -0.464 . . . . 0.87 110.96 -178.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.474 HD21 ' CE ' ' A' ' 51' ' ' MET . 20.4 tp -79.13 -41.2 29.1 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.894 -0.594 . . . . 0.47 110.237 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.33 -28.46 55.68 Favored Glycine 0 C--O 1.226 -0.372 0 C-N-CA 120.946 -0.645 . . . . 0.36 113.843 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.83 -25.66 68.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 117.419 0.61 . . . . 0.47 111.288 -179.116 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.2 t -80.31 -55.69 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 N-CA-C 109.573 -0.528 . . . . 1.38 109.573 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 33.7 mtt -54.47 -39.62 67.65 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.149 0.499 . . . . 0.85 111.035 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -62.4 -38.44 89.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.576 -0.738 . . . . 1.95 111.867 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.2 m -93.12 2.45 56.71 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.078 0.466 . . . . 0.59 111.796 -177.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.0 tp -109.35 -57.91 2.1 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.835 -0.621 . . . . 0.72 110.773 -179.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -145.8 44.61 0.85 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 119.988 -1.101 . . . . 0.56 113.323 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 73.08 140.62 0.06 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.68 0.752 . . . . 2.83 111.834 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -81.68 138.05 47.43 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.384 -0.825 . . . . 0.96 110.496 -179.338 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.72 -165.55 0.3 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.804 2.336 . . . . 0.61 112.862 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 68.6 p -79.3 161.82 26.02 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.949 -0.389 . . . . 0.8 109.949 178.806 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -59.27 -36.95 76.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.788 0.327 . . . . 2.13 110.483 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.3 -47.13 80.66 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.408 -0.36 . . . . 0.7 110.175 179.08 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -63.25 -40.95 98.85 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.119 0.485 . . . . 0.81 110.282 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.509 ' HG ' HG22 ' A' ' 29' ' ' THR . 55.3 tp -59.03 -43.6 91.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.444 -0.798 . . . . 0.76 111.072 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.508 ' O ' HG22 ' A' ' 52' ' ' ILE . 19.1 tt0 -75.74 -35.06 60.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.044 -0.525 . . . . 1.12 111.665 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -68.04 -25.42 65.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.925 0.393 . . . . 1.42 110.844 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.509 ' O ' HG12 ' A' ' 55' ' ' VAL . 1.9 mmm -64.37 -44.96 89.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.364 -0.38 . . . . 0.54 110.068 179.498 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.517 ' HA ' ' CG1' ' A' ' 55' ' ' VAL . 6.9 tp -70.92 -21.35 22.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.077 0.465 . . . . 0.59 109.976 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -78.21 -17.73 56.36 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.994 -0.743 . . . . 1.06 108.994 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.521 ' HG3' ' H ' ' B' ' 288' ' ' ALA . 19.3 tp10 -95.81 -0.67 50.91 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.418 -0.81 . . . . 1.58 111.239 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.713 HG21 ' CE2' ' B' ' 292' ' ' TRP . 1.0 OUTLIER -122.22 -46.27 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 N-CA-C 112.177 0.436 . . . . 0.82 112.177 -179.756 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -76.52 99.75 5.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.41 0.624 . . . . 0.7 111.288 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.71 -22.62 46.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.182 -0.917 . . . . 0.9 111.425 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -76.56 -0.78 24.44 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.194 -0.457 . . . . 0.85 111.967 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.97 46.37 84.45 Favored Glycine 0 C--O 1.224 -0.487 0 C-N-CA 121.554 -0.355 . . . . 1.03 113.977 178.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -127.46 -17.66 4.6 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.419 0.628 . . . . 1.61 109.697 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 76.64 24.08 68.43 Favored Glycine 0 N--CA 1.452 -0.238 0 CA-C-N 115.537 -0.756 . . . . 0.67 112.921 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.0 m -151.75 146.71 25.94 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.938 0.399 . . . . 0.65 110.552 179.106 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.479 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 0.9 OUTLIER -123.93 109.07 22.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.283 0.564 . . . . 0.5 110.023 179.12 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -78.81 -176.65 5.07 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.296 -0.866 . . . . 1.09 110.062 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.493 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 74.8 m-85 -57.72 -53.63 63.66 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 116.262 -0.426 . . . . 1.78 111.309 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 10.5 Cg_endo -56.23 -35.72 95.87 Favored 'Trans proline' 0 C--N 1.357 0.976 0 C-N-CA 122.497 2.131 . . . . 0.79 112.138 178.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.412 ' HB2' HG23 ' A' ' 63' ' ' ILE . 36.9 mt-10 -69.45 -39.21 77.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.164 -0.471 . . . . 0.66 110.047 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -59.66 -39.22 83.71 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.57 -0.741 . . . . 0.77 111.239 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 94.4 mt -64.29 -36.6 84.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.249 0.547 . . . . 0.9 110.599 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.6 m -80.41 -39.6 28.03 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.702 -0.681 . . . . 1.02 111.333 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 7.3 tpt -62.69 -54.45 39.21 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.85 -0.614 . . . . 0.69 112.056 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -4.61 30.24 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.708 0.632 . . . . 0.99 112.708 -177.647 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -101.48 2.9 39.74 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.995 0.426 . . . . 1.21 110.287 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.442 HH11 ' HD3' ' A' ' 74' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.327 -0.384 0 CA-C-N 116.038 -0.528 . . . . 2.56 111.051 -179.209 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 287' ' ' ARG . . . . . 0.421 ' HB3' ' OD1' ' B' ' 290' ' ' ASN . 4.4 ttm180 . . . . . 0 N--CA 1.477 0.91 0 N-CA-C 109.858 -0.423 . . . . 3.11 109.858 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.579 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -67.26 -20.44 65.66 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 112.568 0.581 . . . . 0.6 112.568 -178.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 289' ' ' ALA . . . . . 0.573 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -72.06 -3.49 23.31 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-O 121.356 0.598 . . . . 0.65 112.111 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 290' ' ' ASN . . . . . 0.421 ' OD1' ' HB3' ' B' ' 287' ' ' ARG . 3.2 m120 -111.86 -33.76 6.21 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 122.578 1.18 . . . . 0.87 109.893 175.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 291' ' ' LEU . . . . . 0.415 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 8.1 mp -79.74 -13.11 59.68 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 114.267 -1.333 . . . . 1.37 110.283 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.713 ' CE2' HG21 ' A' ' 55' ' ' VAL . 3.4 m0 -86.88 -54.65 0.38 Allowed Pre-proline 0 CA--C 1.531 0.222 0 N-CA-C 107.385 -1.339 . . . . 0.42 107.385 175.457 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.573 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 18.3 Cg_exo -49.23 -33.21 27.45 Favored 'Trans proline' 0 C--N 1.366 1.465 0 C-N-CA 122.631 2.221 . . . . 0.54 112.812 174.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.586 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 13.7 t -58.22 -63.43 3.96 Favored Pre-proline 0 CA--C 1.547 0.837 0 CA-C-O 118.999 -0.524 . . . . 0.95 110.847 179.427 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.586 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 76.1 Cg_exo -52.22 -35.82 64.86 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 122.243 1.962 . . . . 0.54 112.236 176.359 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 18.7 tp -69.09 -31.42 70.13 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.054 0.454 . . . . 0.56 109.782 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 297' ' ' MET . . . . . 0.404 ' O ' ' HB2' ' B' ' 300' ' ' ARG . 15.5 ttt -71.73 -42.55 67.15 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.175 -1.046 . . . . 1.79 108.175 178.034 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 42.0 mm -62.74 -33.14 58.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 107.94 -1.133 . . . . 0.5 107.94 176.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 299' ' ' LYS . . . . . 0.454 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.1 OUTLIER -64.31 -36.92 85.69 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 108.66 -0.867 . . . . 0.51 108.66 177.664 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 300' ' ' ARG . . . . . 0.404 ' HB2' ' O ' ' B' ' 297' ' ' MET . 44.5 mtt180 -66.7 -36.24 82.02 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.742 -0.836 . . . . 2.44 108.742 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 12.8 m -66.9 -38.33 86.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.973 -1.012 . . . . 0.66 109.275 178.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.45 -35.41 65.75 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.105 -0.702 . . . . 2.44 109.105 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -66.72 -36.06 81.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.399 0.619 . . . . 0.82 109.439 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -72.17 -39.92 68.32 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.197 -0.91 . . . . 1.16 109.145 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 8.4 m . . . . . 0 C--O 1.252 1.2 0 CA-C-O 118.239 -0.886 . . . . 1.39 110.149 179.356 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.214 0 CA-C-O 120.86 0.362 . . . . 2.58 110.387 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.402 ' O ' HG23 ' A' ' 5' ' ' THR . 28.0 m-20 -90.14 50.36 1.85 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.156 -0.475 . . . . 3.47 110.29 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.5 -51.86 56.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.213 -0.448 . . . . 2.95 110.515 -179.054 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.7 mt -89.93 77.67 6.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.011 0.434 . . . . 1.97 109.93 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.402 HG23 ' O ' ' A' ' 2' ' ' ASP . 0.8 OUTLIER -80.14 -85.09 0.09 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.824 -0.625 . . . . 1.68 111.022 -179.868 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 54.39 56.29 7.07 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.665 0.745 . . . . 1.44 109.965 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -116.2 -52.43 2.59 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.219 -0.9 . . . . 1.35 110.128 -178.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -97.7 -34.77 10.79 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.252 -0.885 . . . . 1.61 109.394 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.466 ' HA ' ' CD2' ' A' ' 12' ' ' PHE . 3.1 mt -57.26 -26.95 26.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 114.983 -1.008 . . . . 1.23 111.721 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.98 -25.83 68.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.166 0.508 . . . . 0.98 110.895 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -85.02 -21.26 29.51 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.983 -0.553 . . . . 1.18 111.551 -179.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.466 ' CD2' ' HA ' ' A' ' 9' ' ' ILE . 20.3 m-85 -74.49 -40.93 61.53 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.08 -0.711 . . . . 1.27 109.08 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -68.43 -22.36 64.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.455 -0.793 . . . . 0.99 110.331 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.4 ' CG ' ' HE3' ' B' ' 299' ' ' LYS . 5.1 tp10 -69.62 -27.12 64.81 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.653 -0.703 . . . . 1.29 110.478 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.32 -47.6 85.19 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.673 -0.491 . . . . 0.58 109.673 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -73.89 3.46 6.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.069 0.462 . . . . 0.98 111.61 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.4 m -112.76 -35.0 5.62 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.258 -0.428 . . . . 0.73 111.886 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.433 HD12 ' HG2' ' B' ' 299' ' ' LYS . 79.4 mt -105.13 -26.44 12.09 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.144 0.424 . . . . 0.55 112.144 -178.762 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -83.0 -49.06 9.97 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 121.043 -0.263 . . . . 0.79 111.318 -178.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.64 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 32.5 t70 -92.24 140.02 30.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.955 0.407 . . . . 0.59 111.166 -179.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -125.43 3.44 7.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.0 -0.545 . . . . 1.57 110.5 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.618 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 4.2 m-20 -90.17 -28.6 18.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.161 0.505 . . . . 0.82 109.976 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.89 27.7 9.34 Favored Glycine 0 N--CA 1.444 -0.784 0 N-CA-C 111.118 -0.793 . . . . 0.87 111.118 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -100.48 -31.54 11.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.305 -0.448 . . . . 0.74 111.126 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 69.45 36.99 78.58 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.867 -0.683 . . . . 1.3 112.085 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.4 HG22 ' HA ' ' A' ' 64' ' ' ASP . 5.3 p -139.4 152.96 47.52 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.823 -0.436 . . . . 0.66 109.823 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.444 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 74.5 mt -101.86 111.52 31.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-O 120.975 0.417 . . . . 0.5 110.936 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.7 p -118.71 -178.93 3.66 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.913 -0.773 . . . . 0.77 108.913 178.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.27 -30.45 60.13 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.288 -0.414 . . . . 0.59 111.739 178.432 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -64.71 -46.43 82.35 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.949 -0.568 . . . . 0.56 112.313 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.647 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 50.4 mp0 -81.88 -25.87 34.66 Favored 'General case' 0 C--N 1.332 -0.165 0 O-C-N 121.903 -0.498 . . . . 0.87 111.095 -177.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.5 tp -71.51 -33.55 69.32 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.531 -0.758 . . . . 0.47 110.755 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -91.41 -29.22 12.62 Favored Glycine 0 C--O 1.229 -0.187 0 C-N-CA 120.651 -0.785 . . . . 0.36 113.908 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -60.67 -40.73 93.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 117.354 0.577 . . . . 0.47 112.483 -178.219 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.411 HG11 ' HB3' ' B' ' 295' ' ' PRO . 7.3 p -67.5 -48.21 77.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 121.047 -0.261 . . . . 1.38 110.661 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 43.6 mtt -61.24 -36.63 80.49 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.784 0.326 . . . . 0.85 110.432 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 -56.58 -33.29 66.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.243 -0.89 . . . . 1.95 111.639 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 m -112.38 24.79 12.15 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.178 0.513 . . . . 0.59 111.019 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 22.7 tp -125.6 -49.02 1.65 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.031 -0.531 . . . . 0.72 111.124 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -155.5 43.7 0.55 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 121.015 -0.612 . . . . 0.56 112.214 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 71.67 143.32 0.06 Allowed 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.368 0.667 . . . . 2.83 111.165 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -88.05 133.0 38.12 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.703 -0.68 . . . . 0.96 110.822 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -74.54 -177.34 3.28 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.719 2.28 . . . . 0.61 111.307 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.3 p -78.39 165.15 24.15 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.877 -0.329 . . . . 0.8 110.719 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -57.52 -40.88 79.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.895 0.378 . . . . 2.13 110.957 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.07 -45.53 92.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.7 110.809 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -63.41 -36.55 84.12 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.443 -0.799 . . . . 0.81 111.059 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.7 tp -72.36 -38.29 68.6 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.266 -0.425 . . . . 0.76 110.174 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -59.89 -46.2 90.11 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.594 -0.73 . . . . 1.12 110.316 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -64.52 -37.1 86.37 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.498 -0.774 . . . . 1.42 110.792 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.491 ' O ' HG12 ' A' ' 55' ' ' VAL . 4.1 mmm -63.42 -46.41 86.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.905 -0.588 . . . . 0.54 112.504 -178.736 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 8.4 tp -72.1 -25.97 24.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 120.536 -0.466 . . . . 0.59 110.153 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -75.13 -21.74 58.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.65 0.738 . . . . 1.06 109.667 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.591 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 24.0 tt0 -84.08 -7.09 59.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.855 -1.066 . . . . 1.58 111.058 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.748 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -118.29 -48.95 3.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.451 -0.341 . . . . 0.82 111.234 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.623 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 19.7 t70 -75.01 101.43 4.48 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.781 0.324 . . . . 0.7 110.296 -179.482 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -7.86 56.09 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.044 -0.526 . . . . 0.9 111.535 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.02 -27.85 39.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.989 0.423 . . . . 0.85 111.094 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 92.99 44.8 3.75 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.681 -0.771 . . . . 1.03 114.705 177.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -144.61 -11.97 0.59 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.282 0.541 . . . . 1.61 111.138 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 75.49 26.08 66.44 Favored Glycine 0 C--N 1.33 0.239 0 C-N-CA 120.701 -0.761 . . . . 0.67 112.582 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 93.8 m -138.89 134.83 33.77 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.097 0.475 . . . . 0.65 110.97 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.519 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 0.4 OUTLIER -119.38 119.31 60.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.553 -0.748 . . . . 0.5 110.313 178.59 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.4 ' HA ' HG22 ' A' ' 26' ' ' THR . 3.6 t70 -95.08 -173.17 2.88 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.646 -0.706 . . . . 1.09 110.043 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.519 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 15.1 m-85 -56.6 -52.97 69.4 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.368 -0.378 . . . . 1.78 111.498 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.7 Cg_endo -54.21 -37.2 87.79 Favored 'Trans proline' 0 C--N 1.364 1.365 0 C-N-CA 122.622 2.215 . . . . 0.79 112.258 178.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.648 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 29.1 mt-10 -72.95 -46.01 54.83 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.193 0.52 . . . . 0.66 110.481 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -59.29 -37.46 77.74 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.3 -0.864 . . . . 0.77 111.041 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 62.9 mt -59.65 -30.02 68.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.993 -0.549 . . . . 0.9 111.808 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.82 -37.6 10.67 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.194 0.521 . . . . 1.02 110.987 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.56 ' HE1' ' HA ' ' B' ' 289' ' ' ALA . 14.4 tpt -59.96 -48.94 79.63 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.596 -0.729 . . . . 0.69 112.102 -179.261 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.87 26.09 1.63 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.88 0.326 . . . . 0.99 111.88 -178.484 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -132.02 -36.85 1.16 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.998 0.428 . . . . 1.21 111.342 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -83.31 63.68 7.38 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.766 0.317 . . . . 2.56 111.733 -178.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.4 ptmm? -73.78 138.69 44.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.259 -0.428 . . . . 3.25 110.374 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -69.61 168.86 13.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.411 -0.359 . . . . 2.59 110.311 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -84.03 -16.61 43.29 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.08 0.467 . . . . 2.45 110.589 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -103.65 139.55 38.78 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.569 -0.53 . . . . 2.35 109.569 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.2 m -110.87 136.66 49.57 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.927 -0.579 . . . . 3.14 110.721 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 . . . . . 0 C--O 1.254 1.339 0 CA-C-O 118.557 -0.735 . . . . 3.21 110.343 -179.878 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 287' ' ' ARG . . . . . 0.591 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 110.28 -0.267 . . . . 3.11 110.28 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.531 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . . . -59.93 -31.32 69.74 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-O 120.715 0.293 . . . . 0.6 110.753 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 289' ' ' ALA . . . . . 0.56 ' HA ' ' HE1' ' A' ' 71' ' ' MET . . . -68.57 -14.08 62.77 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 120.844 -0.342 . . . . 0.65 111.435 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 290' ' ' ASN . . . . . 0.496 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 3.5 m120 -102.68 -38.97 7.25 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.01 0.909 . . . . 0.87 109.292 175.03 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 1.1 mp -73.57 -10.28 59.55 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.944 -0.571 . . . . 1.37 111.155 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.748 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 2.6 m0 -87.15 -52.66 0.41 Allowed Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 107.766 -1.198 . . . . 0.42 107.766 175.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.516 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 12.8 Cg_exo -51.55 -33.82 49.66 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 123.454 2.77 . . . . 0.54 112.903 174.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.585 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 14.4 t -58.1 -60.11 11.13 Favored Pre-proline 0 CA--C 1.547 0.845 0 CA-C-O 119.203 -0.427 . . . . 0.95 110.903 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.585 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 78.8 Cg_exo -55.61 -34.37 89.94 Favored 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 122.025 1.816 . . . . 0.54 111.887 176.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 9.4 tp -65.35 -33.66 76.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.187 0.517 . . . . 0.56 109.745 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 2.7 ttt -67.84 -32.99 73.9 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.472 -0.936 . . . . 1.79 108.472 177.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 48.5 mm -69.99 -37.2 71.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.343 -0.984 . . . . 0.5 108.343 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 299' ' ' LYS . . . . . 0.564 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.1 OUTLIER -63.45 -42.23 98.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.169 -0.923 . . . . 0.51 109.264 178.092 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -40.34 94.38 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.258 -0.645 . . . . 2.44 109.258 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 53.7 m -64.54 -39.25 93.41 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.712 -0.676 . . . . 0.66 110.022 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -69.69 -34.61 74.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.086 -0.506 . . . . 2.44 109.89 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -66.44 -28.46 68.62 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.711 0.767 . . . . 0.82 109.503 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -85.5 -36.65 20.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.965 -1.016 . . . . 1.16 109.984 178.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 11.7 m . . . . . 0 C--O 1.255 1.35 0 CA-C-O 118.845 -0.598 . . . . 1.39 110.039 179.083 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 181' ' ' ' CA' . . . . . 0.647 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 182' ' ' ' CA' . . . . . 0.648 'CA ' ' OE1' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.429 ' HB3' ' OE1' ' A' ' 3' ' ' GLN . . . . . . . . 0 N--CA 1.475 0.776 0 N-CA-C 109.595 -0.52 . . . . 2.58 109.595 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -80.93 85.73 6.18 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.113 0.482 . . . . 3.47 111.72 -179.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.429 ' OE1' ' HB3' ' A' ' 1' ' ' ALA . 8.2 mp0 -129.26 -77.22 0.55 Allowed 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.145 -0.687 . . . . 2.95 109.145 178.239 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.9 mt -92.07 51.77 1.86 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.441 -0.8 . . . . 1.97 110.657 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.44 -71.82 0.23 Allowed 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.704 -0.68 . . . . 1.68 110.42 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 42.82 67.0 0.67 Allowed 'General case' 0 N--CA 1.47 0.527 0 O-C-N 123.722 0.639 . . . . 1.44 111.014 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.14 -54.34 2.01 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.745 0.307 . . . . 1.35 111.704 -178.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -88.47 -29.15 20.37 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.071 -0.513 . . . . 1.61 110.79 -178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.466 ' H ' HG13 ' A' ' 9' ' ' ILE . 2.0 mt -56.26 -21.47 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-N 115.73 -0.668 . . . . 1.23 111.82 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.01 -34.63 68.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.876 -0.602 . . . . 0.98 112.061 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -86.11 -21.47 27.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.709 -0.223 . . . . 1.18 111.398 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -71.23 -42.68 68.57 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 120.993 0.425 . . . . 1.27 111.537 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 80.1 mttt -68.73 -19.81 64.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.084 -0.507 . . . . 0.99 110.049 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.44 ' HG3' ' CD1' ' A' ' 18' ' ' LEU . 2.2 tp10 -69.61 -30.79 68.61 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.455 -0.793 . . . . 1.29 110.295 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.512 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -61.04 -46.0 92.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.297 -0.411 . . . . 0.58 110.113 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -84.52 29.29 0.6 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.107 0.48 . . . . 0.98 110.779 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.7 m -137.06 -38.17 0.63 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.947 -0.569 . . . . 0.73 110.712 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.457 HD12 ' HG2' ' B' ' 299' ' ' LYS . 23.3 mt -109.46 -37.91 5.6 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 111.998 0.37 . . . . 0.55 111.998 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.512 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 78.1 t80 -67.26 -43.45 81.83 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.817 0.341 . . . . 0.79 110.396 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.638 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 25.5 t70 -92.29 144.62 25.21 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.002 -0.74 . . . . 0.59 109.002 178.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -119.37 -2.58 10.58 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.784 -0.367 . . . . 1.57 111.761 -178.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.596 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 0.3 OUTLIER -93.23 -42.0 9.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.034 0.445 . . . . 0.82 110.547 -178.541 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 119.48 0.49 13.98 Favored Glycine 0 N--CA 1.442 -0.964 0 CA-C-N 115.456 -0.793 . . . . 0.87 111.651 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -75.61 -46.61 30.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.79 0.329 . . . . 0.74 111.155 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.99 26.22 41.96 Favored Glycine 0 CA--C 1.518 0.267 0 CA-C-N 116.264 -0.425 . . . . 1.3 112.295 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.9 152.05 31.34 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 110.4 -0.222 . . . . 0.66 110.4 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.564 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 10.7 mt -94.53 105.83 17.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.395 0.617 . . . . 0.5 110.802 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.86 165.84 17.33 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 114.786 -1.097 . . . . 0.77 109.215 178.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.82 -33.94 51.53 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.239 0.459 . . . . 0.59 112.239 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -61.85 -46.08 91.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.083 -0.508 . . . . 0.56 112.043 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.66 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 48.7 mp0 -77.12 -25.01 51.65 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.886 0.374 . . . . 0.87 110.95 -178.251 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.472 HD21 ' HE2' ' A' ' 51' ' ' MET . 18.3 tp -76.23 -47.25 24.63 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 116.031 -0.532 . . . . 0.47 110.271 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.99 -36.83 86.96 Favored Glycine 0 C--N 1.333 0.371 0 CA-C-N 115.637 -0.711 . . . . 0.36 114.091 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 p -59.94 -31.49 69.91 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 117.285 0.543 . . . . 0.47 112.406 -178.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.8 t -72.93 -53.42 18.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.811 -0.44 . . . . 1.38 109.811 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 23.9 mtt -58.73 -41.22 85.89 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.734 -0.666 . . . . 0.85 111.457 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.454 ' HG3' ' HB2' ' A' ' 42' ' ' ASN . 1.1 ttt180 -59.49 -43.06 93.42 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.373 -0.376 . . . . 1.95 111.059 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 69.0 m -85.33 -3.69 58.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.978 0.418 . . . . 0.59 111.848 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.0 tp -100.93 -62.13 1.28 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.806 0.336 . . . . 0.72 111.295 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -149.08 62.97 0.41 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.528 -0.844 . . . . 0.56 112.726 -178.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 69.5 158.64 0.17 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.579 0.704 . . . . 2.83 112.043 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.454 ' HB2' ' HG3' ' A' ' 37' ' ' ARG . 3.9 t30 -105.94 135.01 19.48 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.838 -0.619 . . . . 0.96 110.57 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -75.95 -168.04 0.51 Allowed 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.344 2.029 . . . . 0.61 111.45 178.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.5 p -80.39 165.92 21.77 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 110.311 -0.255 . . . . 0.8 110.311 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -65.19 -32.72 74.54 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.556 -0.535 . . . . 2.13 109.556 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.5 -50.09 71.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.726 -0.67 . . . . 0.7 110.15 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -64.92 -33.94 77.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.774 -0.648 . . . . 0.81 110.606 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 47.8 tp -62.81 -38.35 90.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.467 -0.788 . . . . 0.76 110.358 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.564 ' O ' HG22 ' A' ' 52' ' ' ILE . 6.6 tt0 -77.74 -42.07 35.53 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.885 -0.598 . . . . 1.12 110.123 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -59.51 -29.41 67.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.189 0.518 . . . . 1.42 110.455 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.472 ' HE2' HD21 ' A' ' 32' ' ' LEU . 1.7 mmm -69.21 -35.38 76.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.916 -0.584 . . . . 0.54 110.853 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 49' ' ' GLN . 5.0 tp -80.85 -13.09 12.8 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-O 121.467 0.651 . . . . 0.59 109.546 179.246 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -81.16 -27.18 35.54 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.497 -0.774 . . . . 1.06 109.32 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.609 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 22.3 tt0 -94.41 36.37 1.16 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.584 -0.734 . . . . 1.58 110.274 178.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.809 ' HB ' ' HB3' ' B' ' 288' ' ' ALA . 7.1 p -164.59 -32.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 C-N-CA 119.965 -0.694 . . . . 0.82 112.592 -177.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -93.09 80.13 4.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.99 0.424 . . . . 0.7 110.303 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.72 -28.46 61.05 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.55 -0.75 . . . . 0.9 112.791 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -69.48 -14.48 62.9 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.881 0.372 . . . . 0.85 110.828 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.55 51.48 58.47 Favored Glycine 0 C--N 1.333 0.373 0 CA-C-N 116.277 -0.42 . . . . 1.03 113.044 178.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -124.29 -25.7 4.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.17 0.51 . . . . 1.61 110.376 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.2 14.59 47.83 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.799 -0.637 . . . . 0.67 111.891 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.5 m -152.42 139.06 18.75 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 120.995 0.426 . . . . 0.65 111.379 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.647 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.4 OUTLIER -116.13 118.52 59.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 108.737 -0.838 . . . . 0.5 108.737 178.347 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -91.81 -172.39 3.18 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.645 -0.502 . . . . 1.09 109.645 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.491 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 31.0 m-85 -55.88 -53.92 57.8 Favored Pre-proline 0 CA--C 1.532 0.263 0 O-C-N 123.085 0.24 . . . . 1.78 111.17 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.7 Cg_endo -50.93 -43.18 48.86 Favored 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 122.236 1.957 . . . . 0.79 112.02 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.652 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 20.2 mt-10 -69.69 -43.22 72.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.362 -0.381 . . . . 0.66 110.759 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -56.77 -40.98 76.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.833 -0.621 . . . . 0.77 111.335 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.29 -34.75 77.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.686 -0.688 . . . . 0.9 110.7 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.7 m -81.79 -41.82 20.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.132 -0.485 . . . . 1.02 111.137 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.473 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 5.6 tpt -61.92 -50.09 73.58 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.516 0.562 . . . . 0.69 112.516 -178.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.67 -15.1 61.71 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.12 -0.632 . . . . 0.99 112.367 -178.162 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -96.69 -13.16 22.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.141 0.496 . . . . 1.21 110.262 178.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -82.82 66.7 8.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.741 -0.663 . . . . 2.56 110.307 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -79.06 143.05 35.97 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.89 -0.596 . . . . 3.25 111.001 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 3.0 mpp? -104.27 158.16 16.64 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.835 -0.621 . . . . 2.59 110.935 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -90.04 2.95 54.61 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.855 -0.611 . . . . 2.45 109.839 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.43 153.74 43.08 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.626 -0.716 . . . . 2.35 110.261 -178.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.4 m -81.41 101.39 9.82 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.941 -0.572 . . . . 3.14 109.954 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.328 -0.844 . . . . 3.21 110.02 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 287' ' ' ARG . . . . . 0.609 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 5.2 ttm180 . . . . . 0 N--CA 1.477 0.899 0 CA-C-O 120.718 0.294 . . . . 3.11 110.556 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.809 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -63.21 -31.61 72.8 Favored 'General case' 0 C--O 1.216 -0.709 0 N-CA-C 112.621 0.6 . . . . 0.6 112.621 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 289' ' ' ALA . . . . . 0.529 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -63.64 -3.52 2.31 Favored 'General case' 0 C--O 1.216 -0.658 0 N-CA-C 113.335 0.865 . . . . 0.65 113.335 -179.394 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -111.42 -35.97 5.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 122.286 1.041 . . . . 0.87 109.973 177.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 291' ' ' LEU . . . . . 0.4 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 8.2 mp -80.22 -8.36 59.41 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 114.077 -1.419 . . . . 1.37 109.979 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.69 ' CE2' HG21 ' A' ' 55' ' ' VAL . 6.5 m0 -90.72 -54.56 0.28 Allowed Pre-proline 0 CA--C 1.535 0.394 0 N-CA-C 107.176 -1.416 . . . . 0.42 107.176 175.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.539 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 21.4 Cg_exo -50.77 -32.81 38.16 Favored 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 122.751 2.301 . . . . 0.54 112.571 174.002 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.572 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 19.5 t -59.78 -61.76 7.24 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-O 119.124 -0.465 . . . . 0.95 110.688 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.572 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 93.1 Cg_exo -52.06 -36.23 64.77 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 121.594 1.529 . . . . 0.54 112.215 176.221 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 14.2 tp -65.21 -32.68 74.48 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.347 0.594 . . . . 0.56 109.735 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 17.7 ttt -73.31 -45.36 55.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.208 -0.906 . . . . 1.79 108.926 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 46.2 mm -61.1 -33.65 56.92 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 N-CA-C 108.881 -0.785 . . . . 0.5 108.881 178.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 299' ' ' LYS . . . . . 0.567 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.2 OUTLIER -62.95 -43.85 97.65 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.18 -0.918 . . . . 0.51 109.105 178.21 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -41.62 89.7 Favored 'General case' 0 C--N 1.333 -0.113 0 N-CA-C 108.945 -0.761 . . . . 2.44 108.945 178.545 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 67.9 m -65.01 -42.86 94.06 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.619 -0.719 . . . . 0.66 110.676 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 22.5 tptp -67.49 -36.24 80.72 Favored 'General case' 0 C--O 1.225 -0.219 0 N-CA-C 110.014 -0.365 . . . . 2.44 110.014 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 3.2 tttp -63.48 -30.45 71.57 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.942 -0.762 . . . . 0.82 108.942 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -82.07 -31.59 30.74 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.099 -0.955 . . . . 1.16 109.907 178.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.8 m . . . . . 0 C--O 1.247 0.926 0 CA-C-N 115.453 -0.794 . . . . 1.39 111.216 179.827 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 181' ' ' ' CA' . . . . . 0.66 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 182' ' ' ' CA' . . . . . 0.652 'CA ' ' OE1' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 109.859 -0.423 . . . . 2.58 109.859 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -84.93 103.21 13.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.212 0.53 . . . . 3.47 110.732 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -132.09 -56.46 0.98 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.492 -0.776 . . . . 2.95 110.051 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 73.8 mt -85.12 75.02 10.39 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.204 0.526 . . . . 1.97 110.42 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.86 -85.36 0.06 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.444 -0.798 . . . . 1.68 111.278 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 52.31 50.12 19.05 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.448 0.642 . . . . 1.44 110.151 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.462 ' CD ' ' H ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -116.93 -56.17 2.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.077 -0.965 . . . . 1.35 109.988 -179.22 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.462 ' H ' ' CD ' ' A' ' 7' ' ' GLU . 40.2 mt-30 -93.42 -34.23 13.52 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.094 -0.706 . . . . 1.61 109.094 179.576 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.441 ' HA ' ' CD2' ' A' ' 12' ' ' PHE . 2.6 mt -63.88 -25.36 38.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.254 -0.885 . . . . 1.23 110.317 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.79 -35.58 81.07 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.351 -0.386 . . . . 0.98 111.265 -179.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.04 -25.83 36.83 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.016 0.436 . . . . 1.18 110.063 179.549 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.441 ' CD2' ' HA ' ' A' ' 9' ' ' ILE . 22.1 m-30 -69.25 -32.72 72.13 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.439 0.637 . . . . 1.27 109.317 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.8 mttt -70.34 -20.23 63.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.294 -0.866 . . . . 0.99 111.202 179.393 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.561 ' HG3' HD12 ' A' ' 18' ' ' LEU . 3.7 tp10 -66.94 -24.61 66.1 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 109.181 -0.674 . . . . 1.29 109.181 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 19' ' ' PHE . . . -69.28 -37.42 77.85 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.743 -0.466 . . . . 0.58 109.743 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -86.59 14.98 6.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.883 0.373 . . . . 0.98 110.754 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.3 m -129.03 -35.45 1.84 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.952 0.406 . . . . 0.73 110.914 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.561 HD12 ' HG3' ' A' ' 14' ' ' GLU . 44.6 mt -99.37 -28.55 13.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.277 -0.419 . . . . 0.55 111.938 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.447 ' HB2' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -80.93 -57.6 3.47 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.225 0.536 . . . . 0.79 110.005 -179.012 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.641 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 31.1 t70 -82.4 142.0 32.32 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.004 -0.998 . . . . 0.59 111.146 -179.462 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -128.89 6.8 5.53 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.104 -0.702 . . . . 1.57 109.104 178.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.624 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 3.9 m-20 -95.08 -25.72 16.34 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.849 -0.614 . . . . 0.82 111.643 -178.486 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.05 22.14 23.64 Favored Glycine 0 N--CA 1.442 -0.914 0 N-CA-C 110.709 -0.956 . . . . 0.87 110.709 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.636 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 2.5 p30 -95.8 -32.8 12.52 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.641 -0.503 . . . . 0.74 109.641 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.16 28.74 73.82 Favored Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.863 -0.684 . . . . 1.3 112.878 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.5 p -132.35 128.16 37.06 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 122.932 -0.158 . . . . 0.66 111.227 -179.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.474 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 47.9 mt -75.14 112.19 12.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 120.97 0.414 . . . . 0.5 111.379 -179.312 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.5 p -117.8 177.87 4.61 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.417 -0.811 . . . . 0.77 108.815 178.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.457 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -58.02 -28.24 64.27 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.779 0.323 . . . . 0.59 111.143 178.207 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 44.6 tttt -65.88 -44.63 84.78 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 112.175 0.435 . . . . 0.56 112.175 -179.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.649 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 55.3 mp0 -78.98 -22.03 46.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.95 0.405 . . . . 0.87 111.143 -178.658 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.4 tp -83.46 -38.66 21.55 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.096 -0.502 . . . . 0.47 110.748 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.18 -32.75 51.45 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.736 -0.745 . . . . 0.36 113.619 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -60.41 -44.91 95.25 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.272 0.471 . . . . 0.47 112.272 -178.442 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.5 p -66.5 -48.33 80.9 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 120.978 -0.289 . . . . 1.38 110.734 -178.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 56.6 mtt -56.56 -46.38 80.75 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.718 0.294 . . . . 0.85 111.538 178.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -58.39 -29.5 66.09 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.172 -0.467 . . . . 1.95 111.313 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.0 m -99.05 3.88 46.92 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.13 -0.486 . . . . 0.59 111.337 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.5 tp -113.97 -34.14 5.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.314 -0.403 . . . . 0.72 111.408 -178.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -169.3 53.23 0.21 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.225 -0.988 . . . . 0.56 112.829 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 72.89 175.9 0.27 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.495 0.664 . . . . 2.83 111.894 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -116.76 123.72 30.07 Favored Pre-proline 0 C--N 1.318 -0.791 0 CA-C-N 115.273 -0.876 . . . . 0.96 109.56 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -77.48 -163.92 0.24 Allowed 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.162 1.908 . . . . 0.61 111.106 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.6 p -82.55 158.97 22.91 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.01 -0.676 . . . . 0.8 110.195 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.3 mp0 -57.15 -35.28 69.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.97 -0.559 . . . . 2.13 110.533 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.3 -46.14 91.54 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.425 0.631 . . . . 0.7 110.165 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -64.96 -41.11 95.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.216 -0.902 . . . . 0.81 110.37 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.457 ' HG ' HG22 ' A' ' 29' ' ' THR . 18.9 tp -65.05 -43.08 93.48 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.738 -0.664 . . . . 0.76 110.216 179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.476 ' O ' HG22 ' A' ' 52' ' ' ILE . 14.7 tt0 -66.59 -46.76 74.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.288 -0.415 . . . . 1.12 110.66 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -56.18 -35.5 67.31 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.044 0.45 . . . . 1.42 110.741 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.466 ' O ' HG12 ' A' ' 55' ' ' VAL . 2.9 mmm -66.72 -45.96 77.01 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.504 -0.771 . . . . 0.54 111.265 -179.575 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.476 HG22 ' O ' ' A' ' 49' ' ' GLN . 8.9 tp -69.5 -22.99 25.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-O 121.096 0.474 . . . . 0.59 110.251 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.54 -24.97 41.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.675 0.75 . . . . 1.06 109.193 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.497 ' HB3' ' HB2' ' B' ' 288' ' ' ALA . 9.1 tp10 -77.41 -9.54 58.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.01 -0.995 . . . . 1.58 110.372 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.704 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 0.7 OUTLIER -118.9 -49.72 3.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.292 -0.413 . . . . 0.82 111.849 -179.699 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.647 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 30.2 t70 -79.4 103.8 9.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 0.7 110.841 -178.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.32 -25.69 46.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.867 -0.606 . . . . 0.9 112.598 -178.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -64.14 -39.25 93.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.683 -0.235 . . . . 0.85 111.419 -179.031 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 101.99 31.21 5.46 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.38 -0.914 . . . . 1.03 113.332 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -127.86 -6.04 5.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.84 0.352 . . . . 1.61 110.807 179.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.48 34.69 88.51 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.663 -0.779 . . . . 0.67 112.252 179.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.7 m -142.74 131.69 22.96 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 110.014 -0.365 . . . . 0.65 110.014 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.546 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.1 OUTLIER -113.35 121.71 66.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.141 0.496 . . . . 0.5 111.16 179.662 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -92.43 -176.96 4.47 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.488 -0.778 . . . . 1.09 110.747 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.509 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 36.1 m-85 -52.92 -54.9 38.7 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 116.467 -0.333 . . . . 1.78 111.788 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.8 Cg_endo -59.13 -32.57 97.47 Favored 'Trans proline' 0 C--N 1.36 1.152 0 C-N-CA 122.121 1.881 . . . . 0.79 113.674 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.617 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 38.0 mt-10 -70.39 -42.88 71.12 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.252 0.549 . . . . 0.66 110.296 -178.818 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -66.68 -44.34 82.01 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.584 -0.734 . . . . 0.77 110.73 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 81.4 mt -59.73 -29.62 68.26 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.427 -0.352 . . . . 0.9 111.409 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.7 m -81.92 -44.6 16.58 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.097 0.406 . . . . 1.02 112.097 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.639 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 24.5 ttt -67.27 -49.73 63.22 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.676 0.621 . . . . 0.69 112.676 -178.235 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.453 ' HE1' ' HB3' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -74.34 3.45 7.35 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.892 0.701 . . . . 0.99 112.892 -178.122 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -115.44 -11.08 11.88 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.257 0.551 . . . . 1.21 109.997 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.66 58.53 5.09 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.473 -0.785 . . . . 2.56 110.173 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.2 ptmm? -78.15 133.34 37.83 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.983 -0.553 . . . . 3.25 111.391 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 5.2 mpp? -89.32 -175.53 4.78 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.789 -0.641 . . . . 2.59 109.598 179.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -101.17 -4.03 28.0 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.494 -0.928 . . . . 2.45 108.494 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -68.94 145.36 53.7 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 114.297 -1.319 . . . . 2.35 110.377 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.2 m -116.08 104.92 12.04 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.136 -0.484 . . . . 3.14 110.84 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 C--O 1.245 0.821 0 CA-C-O 118.454 -0.784 . . . . 3.21 110.03 179.119 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 287' ' ' ARG . . . . . 0.43 ' HB3' ' OD1' ' B' ' 290' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 109.488 -0.56 . . . . 3.11 109.488 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.497 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . . . -72.25 -24.8 61.42 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-O 121.232 0.539 . . . . 0.6 110.975 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 289' ' ' ALA . . . . . 0.639 ' HA ' ' CE ' ' A' ' 71' ' ' MET . . . -68.53 -0.55 5.21 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.219 0.822 . . . . 0.65 113.219 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 290' ' ' ASN . . . . . 0.511 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 2.9 m120 -114.38 -36.47 4.63 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 123.233 1.492 . . . . 0.87 109.745 176.105 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 6.4 mt -80.82 -3.06 49.76 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 113.018 -1.901 . . . . 1.37 111.156 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.704 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 3.1 m0 -100.04 -52.7 0.18 Allowed Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 107.449 -1.315 . . . . 0.42 107.449 174.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.59 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 11.6 Cg_exo -49.54 -39.05 45.75 Favored 'Trans proline' 0 C--N 1.376 1.978 0 C-N-CA 122.969 2.446 . . . . 0.54 111.545 175.304 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.461 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 3.1 t -60.83 -64.05 3.58 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 108.617 -0.883 . . . . 0.95 108.617 177.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.461 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 2.8 Cg_exo -47.3 -36.17 22.16 Favored 'Trans proline' 0 C--N 1.359 1.11 0 C-N-CA 122.599 2.2 . . . . 0.54 112.834 174.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 13.0 tp -70.85 -37.49 73.14 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 120.725 0.298 . . . . 0.56 110.528 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 14.6 ttt -65.08 -36.25 83.74 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.522 -0.918 . . . . 1.79 108.522 178.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 30.9 mm -66.07 -37.52 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-N 114.776 -1.102 . . . . 0.5 108.434 176.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 299' ' ' LYS . . . . . 0.528 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.2 OUTLIER -65.08 -40.99 95.44 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 108.684 -0.858 . . . . 0.51 108.684 177.355 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 16.9 mtp180 -61.91 -38.69 89.33 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.04 -0.726 . . . . 2.44 109.04 178.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 67.2 m -64.03 -45.21 89.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.562 -0.745 . . . . 0.66 110.339 178.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 15.6 tptp -68.56 -30.6 69.41 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.101 0.476 . . . . 2.44 109.863 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 6.1 tttp -68.2 -31.23 70.61 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.896 0.855 . . . . 0.82 108.796 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -77.41 -40.05 44.92 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.66 -1.155 . . . . 1.16 108.932 177.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 C--O 1.247 0.963 0 CA-C-N 115.61 -0.723 . . . . 1.39 111.025 178.836 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 181' ' ' ' CA' . . . . . 0.649 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 182' ' ' ' CA' . . . . . 0.647 'CA ' ' OD1' ' A' ' 56' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.993 0 N-CA-C 110.207 -0.294 . . . . 2.58 110.207 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -79.07 70.55 5.45 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.22 0.533 . . . . 3.47 111.405 -179.38 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -102.34 -55.06 2.54 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.876 -0.602 . . . . 2.95 109.48 179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 89.7 mt -97.75 76.94 2.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.53 -0.759 . . . . 1.97 110.303 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.0 p -75.66 -82.14 0.07 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.478 -0.783 . . . . 1.68 110.971 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 49.03 47.16 22.12 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.837 -0.62 . . . . 1.44 111.3 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.06 -55.0 2.57 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.014 -0.539 . . . . 1.35 109.955 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -94.9 -32.96 12.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.446 0.641 . . . . 1.61 109.528 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.416 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 4.5 mt -58.11 -26.96 30.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.277 -0.874 . . . . 1.23 111.037 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.37 -32.15 73.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.097 -0.501 . . . . 0.98 110.844 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -81.31 -27.97 34.79 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.27 -0.423 . . . . 1.18 110.734 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -72.38 -36.62 68.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.841 -0.618 . . . . 1.27 109.79 178.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 91.4 mttt -67.89 -26.4 65.98 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.824 -0.626 . . . . 0.99 110.227 179.083 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.508 ' HG2' ' HE3' ' B' ' 299' ' ' LYS . 4.9 tp10 -60.78 -33.63 73.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.54 -0.754 . . . . 1.29 109.939 178.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.01 -41.5 99.57 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.921 -0.581 . . . . 0.58 109.741 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -77.1 3.03 13.44 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.214 -0.448 . . . . 0.98 111.56 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 7.5 m -117.54 -36.98 3.56 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.194 -0.457 . . . . 0.73 111.486 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.457 HD12 ' HG2' ' B' ' 299' ' ' LYS . 89.1 mt -96.3 -20.09 18.78 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.102 0.408 . . . . 0.55 112.102 -179.084 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -85.86 -53.62 5.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.9 0.381 . . . . 0.79 110.216 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.66 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 23.6 t70 -83.06 142.58 31.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.481 -0.781 . . . . 0.59 111.631 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.8 mptt -127.77 -10.06 5.54 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.999 -0.546 . . . . 1.57 110.622 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.604 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 0.4 OUTLIER -78.81 -41.46 30.2 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 120.983 0.421 . . . . 0.82 110.198 -178.871 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 115.94 1.62 20.81 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 111.187 -0.765 . . . . 0.87 111.187 -178.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -72.47 -36.09 68.38 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.885 -0.413 . . . . 0.74 109.885 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.54 35.78 62.74 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.871 -0.68 . . . . 1.3 112.467 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.76 145.7 38.59 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 110.273 -0.269 . . . . 0.66 110.273 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 65.1 mt -87.91 111.29 21.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 C-N-CA 120.661 -0.416 . . . . 0.5 110.793 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.3 p -123.65 -177.5 3.75 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.777 -0.823 . . . . 0.77 108.777 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.612 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -57.75 -30.94 66.0 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.474 0.546 . . . . 0.59 112.474 179.015 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -64.32 -48.23 76.41 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.03 0.752 . . . . 0.56 113.03 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.651 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 51.1 mp0 -79.31 -22.52 44.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.449 0.642 . . . . 0.87 110.954 -177.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 35.8 tp -74.33 -35.97 63.64 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.2 -0.909 . . . . 0.47 110.742 -179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -88.26 -29.17 20.55 Favored Glycine 0 CA--C 1.518 0.246 0 C-N-CA 120.786 -0.721 . . . . 0.36 113.099 -179.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.407 ' OG1' ' HA ' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -60.78 -40.97 94.56 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.944 0.372 . . . . 0.47 111.541 -178.663 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.431 HG13 ' N ' ' A' ' 36' ' ' MET . 14.5 p -68.96 -48.29 71.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.523 -0.308 . . . . 1.38 110.403 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.431 ' N ' HG13 ' A' ' 35' ' ' VAL . 61.6 mtt -60.22 -42.27 94.81 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.675 -0.239 . . . . 0.85 111.267 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -35.07 74.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.306 -0.406 . . . . 1.95 110.769 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.7 m -91.09 0.35 57.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.259 -0.428 . . . . 0.59 111.367 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.3 tp -103.92 -57.89 1.96 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.782 0.325 . . . . 0.72 110.983 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -151.19 45.67 0.63 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.675 -0.774 . . . . 0.56 111.899 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 71.21 155.96 0.15 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.423 0.689 . . . . 2.83 110.984 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -106.6 138.0 19.63 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.25 -0.432 . . . . 0.96 110.853 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.38 -164.45 0.16 Allowed 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 122.572 2.181 . . . . 0.61 111.421 178.189 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.1 p -75.86 163.51 27.15 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.835 -0.346 . . . . 0.8 110.363 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -62.96 -30.45 71.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.045 -0.525 . . . . 2.13 110.963 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.87 -42.61 99.83 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.151 0.5 . . . . 0.7 110.667 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -71.56 -36.28 70.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.776 -0.647 . . . . 0.81 110.107 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.612 ' HG ' HG22 ' A' ' 29' ' ' THR . 59.6 tp -64.14 -45.76 87.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.619 -0.718 . . . . 0.76 110.381 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -69.11 -32.13 71.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.952 0.405 . . . . 1.12 110.829 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -69.71 -38.98 77.13 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.302 -0.408 . . . . 1.42 110.155 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.448 ' O ' HG12 ' A' ' 55' ' ' VAL . 4.9 mmm -57.5 -46.35 83.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.72 -0.673 . . . . 0.54 112.125 -179.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.404 ' HA ' ' CG1' ' A' ' 55' ' ' VAL . 8.8 tp -69.16 -22.44 26.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 120.603 -0.439 . . . . 0.59 111.263 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -22.83 51.83 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.212 0.53 . . . . 1.06 109.6 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.603 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 7.3 tt0 -82.36 -18.73 41.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.678 -0.692 . . . . 1.58 110.665 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.784 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -103.72 -48.33 10.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.153 0.427 . . . . 0.82 112.153 -179.71 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.645 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 20.0 t70 -83.35 106.01 14.77 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.274 0.559 . . . . 0.7 110.932 -179.033 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.2 -20.4 28.6 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.503 -0.771 . . . . 0.9 112.057 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.34 -29.43 69.62 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 110.037 -0.357 . . . . 0.85 110.037 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 91.41 34.15 7.63 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.77 -0.729 . . . . 1.03 114.11 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -129.65 -5.96 4.64 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 122.512 -0.405 . . . . 1.61 110.187 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.11 13.57 64.73 Favored Glycine 0 C--N 1.336 0.57 0 C-N-CA 121.282 -0.485 . . . . 0.67 112.954 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 3.9 m -119.04 130.07 55.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.751 0.31 . . . . 0.65 110.51 -179.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.631 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.4 OUTLIER -121.21 120.0 60.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.962 -0.563 . . . . 0.5 110.685 178.96 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -99.2 -172.91 2.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.164 -0.925 . . . . 1.09 109.955 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.528 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 4.3 m-85 -54.07 -54.97 41.39 Favored Pre-proline 0 N--CA 1.466 0.366 0 C-N-CA 122.549 0.339 . . . . 1.78 111.593 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.8 Cg_endo -52.13 -42.13 61.06 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 122.684 2.256 . . . . 0.79 112.775 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.653 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 34.8 mt-10 -69.0 -48.08 63.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.66 110.373 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -58.58 -47.42 84.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.511 -0.768 . . . . 0.77 111.75 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 70.2 mt -59.3 -26.75 65.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.209 -0.45 . . . . 0.9 111.811 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.5 m -93.55 -36.42 12.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.523 -0.308 . . . . 1.02 110.995 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.427 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 6.5 tpt -62.63 -47.94 81.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.69 111.47 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.26 2.88 6.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.102 -0.499 . . . . 0.99 111.3 -179.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -119.8 11.88 11.99 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.212 0.53 . . . . 1.21 110.364 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.2 mmm180 -113.72 75.49 0.93 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.8 -0.636 . . . . 2.56 110.858 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.66 120.57 42.0 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.068 -0.514 . . . . 3.25 110.2 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 4.4 mpp? -61.16 158.02 14.8 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.628 -0.715 . . . . 2.59 109.751 178.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -77.51 66.44 3.24 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.149 0.5 . . . . 2.45 110.683 -179.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -132.51 144.03 50.16 Favored 'General case' 0 CA--C 1.506 -0.73 0 CA-C-N 115.566 -0.743 . . . . 2.35 110.106 -178.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.5 m -74.41 105.82 5.74 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.933 -0.576 . . . . 3.14 110.107 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.391 -0.814 . . . . 3.21 110.51 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 287' ' ' ARG . . . . . 0.603 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 1.5 ttm180 . . . . . 0 N--CA 1.479 1.005 0 N-CA-C 109.833 -0.432 . . . . 3.11 109.833 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 288' ' ' ALA . . . . . . . . . . . . . . . -57.95 -30.57 66.08 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 113.148 0.796 . . . . 0.6 113.148 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 289' ' ' ALA . . . . . 0.699 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -67.67 -15.27 63.56 Favored 'General case' 0 C--O 1.201 -1.478 0 CA-C-O 118.728 -0.653 . . . . 0.65 109.838 -178.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -98.45 -40.34 8.32 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 118.477 0.58 . . . . 0.87 110.884 174.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 9.0 mp -75.2 -9.91 58.98 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 115.545 -0.752 . . . . 1.37 111.263 -179.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.784 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 2.2 m95 -88.92 -54.59 0.32 Allowed Pre-proline 0 C--N 1.321 -0.638 0 N-CA-C 107.601 -1.259 . . . . 0.42 107.601 175.344 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.699 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 6.6 Cg_exo -48.02 -36.76 28.6 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 123.653 2.902 . . . . 0.54 113.141 174.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.529 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 12.5 t -59.39 -62.03 6.67 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 119.126 -0.464 . . . . 0.95 111.332 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.529 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 92.7 Cg_exo -51.33 -35.87 55.48 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 122.016 1.811 . . . . 0.54 112.178 176.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 46.3 tp -66.95 -38.44 86.12 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.719 -0.474 . . . . 0.56 109.719 178.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 27.5 ttt -63.53 -37.07 85.91 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.52 -0.919 . . . . 1.79 108.52 177.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 44.0 mm -64.33 -38.99 83.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 108.379 -0.971 . . . . 0.5 108.379 177.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 299' ' ' LYS . . . . . 0.508 ' HE3' ' HG2' ' A' ' 14' ' ' GLU . 0.1 OUTLIER -62.16 -44.17 97.21 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.866 -0.606 . . . . 0.51 109.474 178.087 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -62.83 -38.2 89.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.743 -0.662 . . . . 2.44 109.769 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 22.7 m -67.75 -33.89 75.74 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.929 -0.578 . . . . 0.66 109.833 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -77.27 -29.68 54.01 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.14 -0.689 . . . . 2.44 109.14 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 303' ' ' LYS . . . . . 0.498 ' HG3' ' HG2' ' A' ' 14' ' ' GLU . 0.9 OUTLIER -70.51 -33.73 71.53 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 108.404 -0.962 . . . . 0.82 108.404 178.893 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -77.62 -40.54 41.61 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.34 -0.985 . . . . 1.16 108.34 177.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 3.5 m . . . . . 0 C--O 1.251 1.172 0 CA-C-N 115.768 -0.651 . . . . 1.39 111.221 177.858 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 181' ' ' ' CA' . . . . . 0.66 'CA ' ' OD1' ' A' ' 20' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 182' ' ' ' CA' . . . . . 0.653 'CA ' ' OE1' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.406 ' HB3' ' OE1' ' A' ' 3' ' ' GLN . . . . . . . . 0 N--CA 1.475 0.824 0 N-CA-C 109.88 -0.415 . . . . 2.58 109.88 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -77.79 -11.27 59.87 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.182 0.438 . . . . 3.47 112.182 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.406 ' OE1' ' HB3' ' A' ' 1' ' ' ALA . 0.0 OUTLIER -78.81 -59.76 2.65 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 121.943 -0.473 . . . . 2.95 111.216 -179.797 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.4 mt -86.18 79.0 9.25 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.077 0.465 . . . . 1.97 110.08 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.9 p -87.32 -72.8 0.5 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.36 -0.837 . . . . 1.68 110.778 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 52.21 56.4 7.79 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.631 -0.713 . . . . 1.44 111.275 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.39 -94.68 0.46 Allowed 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.468 -0.568 . . . . 1.35 109.468 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -60.02 -31.02 69.55 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.737 0.303 . . . . 1.61 110.19 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.413 ' HA ' ' CD2' ' A' ' 12' ' ' PHE . 14.8 mt -59.76 -35.73 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-O 121.004 0.43 . . . . 1.23 111.055 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.79 -31.3 69.14 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.43 0.634 . . . . 0.98 110.695 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -73.72 -21.63 60.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.538 0.685 . . . . 1.18 109.781 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.413 ' CD2' ' HA ' ' A' ' 9' ' ' ILE . 20.1 m-85 -76.36 -35.06 58.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.319 -0.855 . . . . 1.27 109.758 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.604 ' HA ' ' CD2' ' A' ' 16' ' ' PHE . 81.6 mttt -66.21 -28.85 69.06 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.498 0.666 . . . . 0.99 109.427 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.402 ' HB3' ' HZ2' ' B' ' 299' ' ' LYS . 3.8 tp10 -60.0 -36.81 78.0 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.775 -1.102 . . . . 1.29 110.851 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.471 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -64.49 -39.19 93.33 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.939 -0.573 . . . . 0.58 111.011 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.604 ' CD2' ' HA ' ' A' ' 13' ' ' LYS . 9.7 m-85 -65.75 -14.0 60.46 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.704 0.288 . . . . 0.98 111.444 -179.282 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 42.5 m -110.71 -36.03 5.83 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.382 0.512 . . . . 0.73 112.382 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.0 mt -91.93 -22.93 19.77 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.337 0.495 . . . . 0.55 112.337 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.471 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 84.8 t80 -91.55 -50.01 6.0 Favored 'General case' 0 C--N 1.327 -0.38 0 O-C-N 122.353 -0.217 . . . . 0.79 110.622 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.638 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 24.1 t70 -80.46 148.52 30.45 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.384 -0.371 . . . . 0.59 111.099 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -130.61 15.04 5.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.32 -0.4 . . . . 1.57 111.361 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -108.94 -38.34 5.61 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.063 0.459 . . . . 0.82 110.525 -178.666 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 122.64 -13.15 8.75 Favored Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 111.109 -0.797 . . . . 0.87 111.109 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -69.1 -39.52 78.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.424 -0.388 . . . . 0.74 110.986 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 75.18 24.96 69.88 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.873 -0.68 . . . . 1.3 112.903 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.703 HG22 ' HA ' ' A' ' 64' ' ' ASP . 22.5 p -119.7 156.26 30.83 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.935 0.368 . . . . 0.66 110.727 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.594 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 55.7 mt -96.14 108.35 21.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.027 0.441 . . . . 0.5 111.36 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.68 175.9 6.0 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.425 -0.807 . . . . 0.77 109.592 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.474 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -53.43 -41.81 66.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.234 0.54 . . . . 0.59 111.892 179.916 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -58.03 -53.3 59.76 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.343 -0.844 . . . . 0.56 113.269 -178.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.653 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 18.4 mp0 -75.73 -23.49 56.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.679 0.276 . . . . 0.87 111.716 -177.531 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.427 HD11 ' CD1' ' B' ' 292' ' ' TRP . 14.4 tp -69.93 -49.98 46.6 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.05 -0.523 . . . . 0.47 109.966 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.585 ' O ' ' HB2' ' A' ' 37' ' ' ARG . . . -71.68 -36.91 61.83 Favored Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 115.47 -0.786 . . . . 0.36 113.634 -178.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.62 -41.23 89.94 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 117.825 0.813 . . . . 0.47 112.232 -178.349 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.405 HG11 ' HB3' ' B' ' 295' ' ' PRO . 72.7 t -71.93 -57.02 8.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.666 0.27 . . . . 1.38 110.918 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 36.3 mtt -58.43 -27.56 64.44 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.396 -0.365 . . . . 0.85 111.517 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.585 ' HB2' ' O ' ' A' ' 33' ' ' GLY . 43.6 ttt180 -62.97 -32.69 74.07 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.986 -0.552 . . . . 1.95 111.158 178.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.5 m -94.3 -3.98 49.54 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.955 -0.566 . . . . 0.59 111.373 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.4 tp -95.33 -42.35 8.56 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.251 -0.431 . . . . 0.72 110.858 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 41' ' ' GLN . . . -163.31 38.35 0.33 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.699 -0.763 . . . . 0.56 112.163 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 40' ' ' GLY . 1.2 mp0 71.79 154.01 0.13 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.449 0.642 . . . . 2.83 111.644 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -119.28 139.24 27.32 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.034 -0.53 . . . . 0.96 110.117 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -77.12 -157.76 0.07 OUTLIER 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.312 2.008 . . . . 0.61 113.045 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.0 p -77.73 160.85 28.15 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 122.045 -0.409 . . . . 0.8 111.911 -178.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -54.71 -31.53 58.28 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.744 -0.662 . . . . 2.13 110.865 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.4 -54.22 40.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 0.7 110.597 179.041 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -64.19 -34.02 77.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.746 -0.661 . . . . 0.81 110.515 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.474 ' HG ' HG22 ' A' ' 29' ' ' THR . 46.6 tp -67.71 -41.61 83.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.671 -0.695 . . . . 0.76 110.747 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.498 ' O ' HG22 ' A' ' 52' ' ' ILE . 23.0 tt0 -67.35 -32.23 73.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.169 -0.469 . . . . 1.12 110.144 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -66.87 -32.36 73.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.203 0.525 . . . . 1.42 109.922 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.4 mmm -64.61 -38.78 92.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.425 -0.807 . . . . 0.54 111.276 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.498 HG22 ' O ' ' A' ' 49' ' ' GLN . 6.9 tp -75.89 -12.64 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.152 0.501 . . . . 0.59 110.914 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -85.44 -21.75 28.6 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.932 -0.766 . . . . 1.06 108.932 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.674 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 11.4 tt0 -89.76 16.8 7.37 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.384 -1.28 . . . . 1.58 110.572 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.712 ' HB ' ' HB3' ' B' ' 288' ' ' ALA . 6.6 p -146.82 -38.6 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 120.094 -0.642 . . . . 0.82 112.557 -177.229 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.632 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 20.7 t70 -85.79 98.49 10.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.319 0.58 . . . . 0.7 109.716 178.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.4 -19.77 29.21 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 113.018 0.747 . . . . 0.9 113.018 -177.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -71.4 -36.62 71.44 Favored 'General case' 0 C--N 1.327 -0.39 0 O-C-N 122.444 -0.16 . . . . 0.85 110.821 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 101.25 49.0 1.37 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.204 -0.998 . . . . 1.03 113.839 178.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 27.0 p-10 -135.31 -14.53 1.98 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 117.111 0.456 . . . . 1.61 110.531 178.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 72.69 24.84 75.41 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 121.087 -0.577 . . . . 0.67 112.63 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 18.4 m -155.35 126.72 7.26 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.78 -0.452 . . . . 0.65 109.78 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.485 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.6 OUTLIER -100.47 108.85 23.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 120.456 -0.498 . . . . 0.5 110.479 179.829 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.703 ' HA ' HG22 ' A' ' 26' ' ' THR . 28.5 t0 -83.17 175.04 10.26 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.097 -0.956 . . . . 1.09 110.052 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.448 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 4.5 m-85 -46.17 -53.69 21.25 Favored Pre-proline 0 CA--C 1.544 0.725 0 N-CA-C 112.915 0.709 . . . . 1.78 112.915 -178.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.448 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 19.7 Cg_endo -59.14 -38.56 85.84 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 122.138 1.892 . . . . 0.79 112.866 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.634 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 27.0 mt-10 -66.53 -40.38 89.1 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.187 0.518 . . . . 0.66 110.257 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -63.38 -36.33 83.35 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.45 -0.795 . . . . 0.77 110.903 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.5 mt -62.34 -23.37 66.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.181 -0.463 . . . . 0.9 111.693 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.11 -40.42 9.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.192 0.52 . . . . 1.02 110.508 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.573 ' HE3' ' HA ' ' B' ' 289' ' ' ALA . 10.9 tpt -54.84 -48.83 72.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.264 -0.88 . . . . 0.69 111.803 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.429 ' SD ' ' HG3' ' A' ' 71' ' ' MET . 0.1 OUTLIER -89.8 22.93 2.9 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 122.241 -0.287 . . . . 0.99 111.77 -179.442 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.09 -41.81 1.11 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.298 0.571 . . . . 1.21 111.454 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -86.48 84.18 7.48 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.016 -0.538 . . . . 2.56 110.829 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.7 pttt -93.22 161.86 14.24 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.69 -0.485 . . . . 3.25 109.69 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.9 tpp -86.91 143.43 27.41 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.724 0.297 . . . . 2.59 110.777 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -79.03 65.88 4.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.268 0.556 . . . . 2.45 110.974 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -111.96 174.22 5.98 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.912 -0.585 . . . . 2.35 109.866 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.69 45.57 1.3 Allowed 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.533 0.683 . . . . 3.14 110.577 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 . . . . . 0 C--O 1.251 1.149 0 CA-C-N 115.107 -0.952 . . . . 3.21 110.391 -179.932 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 287' ' ' ARG . . . . . 0.674 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 1.4 tpm_? . . . . . 0 N--CA 1.479 0.978 0 N-CA-C 110.564 -0.162 . . . . 3.11 110.564 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.712 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -58.44 -30.91 67.28 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 120.801 0.334 . . . . 0.6 111.39 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 289' ' ' ALA . . . . . 0.717 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -70.44 -12.21 61.42 Favored 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 116.05 -0.523 . . . . 0.65 111.316 -178.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 290' ' ' ASN . . . . . 0.448 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 14.8 m120 -99.87 -40.86 7.48 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-O 121.76 0.791 . . . . 0.87 110.033 173.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 291' ' ' LEU . . . . . 0.585 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 5.7 mt -66.38 -44.54 82.85 Favored 'General case' 0 C--O 1.206 -1.211 0 CA-C-N 114.77 -1.105 . . . . 1.37 109.42 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.681 ' CE2' HG21 ' A' ' 55' ' ' VAL . 10.3 m0 -56.29 -53.92 58.56 Favored Pre-proline 0 N--CA 1.467 0.411 0 N-CA-C 109.519 -0.549 . . . . 0.42 109.519 177.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.717 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 13.1 Cg_exo -47.79 -31.56 15.24 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 122.673 2.248 . . . . 0.54 112.951 175.205 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.571 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 6.0 m -58.05 -65.0 2.11 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-O 118.459 -0.781 . . . . 0.95 110.847 178.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.585 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 86.9 Cg_exo -52.56 -33.75 59.65 Favored 'Trans proline' 0 C--N 1.369 1.65 0 C-N-CA 121.62 1.547 . . . . 0.54 112.884 176.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 10.7 tp -67.09 -38.79 86.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.234 0.54 . . . . 0.56 109.609 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 24.8 ttt -67.47 -38.93 85.15 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.715 -0.846 . . . . 1.79 108.715 178.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 298' ' ' ILE . . . . . 0.482 HG12 ' O ' ' B' ' 294' ' ' SER . 18.3 mm -66.91 -36.2 76.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.021 -0.991 . . . . 0.5 108.689 177.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 299' ' ' LYS . . . . . 0.402 ' HZ2' ' HB3' ' A' ' 14' ' ' GLU . 0.1 OUTLIER -63.75 -35.75 81.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.698 -0.683 . . . . 0.51 109.419 178.199 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 2.4 mmt180 -68.12 -38.4 82.18 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.855 -0.611 . . . . 2.44 109.583 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 28.6 m -69.62 -33.74 73.09 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.54 -0.754 . . . . 0.66 110.401 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -77.11 -32.83 56.83 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.292 -0.632 . . . . 2.44 109.292 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.5 -33.2 74.61 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.705 -0.68 . . . . 0.82 109.202 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -77.88 -35.96 50.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.254 -0.885 . . . . 1.16 109.941 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.5 t . . . . . 0 C--O 1.252 1.201 0 CA-C-O 118.108 -0.949 . . . . 1.39 110.301 179.662 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 181' ' ' ' CA' . . . . . 0.653 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 182' ' ' ' CA' . . . . . 0.634 'CA ' ' OE1' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 110.003 -0.369 . . . . 2.58 110.003 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -82.78 62.1 6.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.287 0.565 . . . . 3.47 111.091 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.28 -39.02 25.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.722 -0.672 . . . . 2.95 110.227 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.1 mt -84.47 60.71 6.2 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.021 -0.536 . . . . 1.97 110.909 -179.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.27 -79.52 0.16 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.515 -0.766 . . . . 1.68 110.772 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.46 ' CD ' ' HZ1' ' A' ' 13' ' ' LYS . 2.2 mm-40 49.26 61.34 3.19 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.977 -0.556 . . . . 1.44 111.213 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.14 -44.68 1.15 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.676 -0.693 . . . . 1.35 109.631 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -87.24 -37.55 17.14 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.69 -0.856 . . . . 1.61 108.69 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.446 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 2.8 mt -58.97 -31.86 46.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.149 -0.932 . . . . 1.23 111.143 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.26 -37.81 88.69 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.371 -0.603 . . . . 0.98 109.371 178.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -71.76 -32.31 67.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.308 -0.86 . . . . 1.18 110.315 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.1 m-30 -70.93 -37.27 72.88 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.068 -0.514 . . . . 1.27 110.45 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.46 ' HZ1' ' CD ' ' A' ' 6' ' ' GLU . 82.6 mttt -64.71 -32.99 74.92 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 121.61 0.719 . . . . 0.99 110.046 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.487 ' HA ' ' OE1' ' A' ' 14' ' ' GLU . 1.4 tp10 -59.64 -32.28 70.29 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.459 -0.791 . . . . 1.29 110.639 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.31 -45.76 86.53 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.147 -0.479 . . . . 0.58 110.738 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -82.1 12.23 4.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.799 0.333 . . . . 0.98 111.808 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.8 m -123.05 -44.27 2.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.365 -0.38 . . . . 0.73 111.019 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.48 ' HB2' ' CG ' ' B' ' 299' ' ' LYS . 92.4 mt -88.98 -31.85 17.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.826 0.346 . . . . 0.55 111.456 -179.329 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -77.54 -56.34 4.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.882 0.372 . . . . 0.79 110.43 -179.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.638 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 19.8 t70 -86.02 140.17 30.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.812 -0.631 . . . . 0.59 110.751 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.3 mptt -119.22 -0.17 11.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.923 -0.581 . . . . 1.57 111.305 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.635 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 9.7 m-20 -86.95 -45.07 11.14 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.087 0.47 . . . . 0.82 110.031 -179.517 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 119.26 -6.66 12.9 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 110.586 -1.006 . . . . 0.87 110.586 -178.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -61.52 -33.52 73.96 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 114.642 -0.779 . . . . 0.74 109.966 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.66 41.97 97.49 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.008 -0.615 . . . . 1.3 112.77 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -141.9 145.85 35.07 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.811 -0.194 . . . . 0.66 110.517 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.491 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 89.9 mt -84.68 106.47 14.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.076 0.465 . . . . 0.5 110.355 178.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.09 178.11 4.75 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.869 -0.605 . . . . 0.77 109.651 179.439 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.52 -35.22 67.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.01 0.433 . . . . 0.59 111.086 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -58.91 -49.08 79.15 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.943 -0.571 . . . . 0.56 112.168 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.653 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 54.8 mp0 -81.01 -26.01 36.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.257 0.551 . . . . 0.87 111.335 -178.238 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.459 HD21 ' CE ' ' A' ' 51' ' ' MET . 20.1 tp -72.35 -32.85 66.83 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.387 -0.824 . . . . 0.47 110.213 -179.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -86.74 -33.37 13.06 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.87 -0.681 . . . . 0.36 113.825 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.88 -40.03 79.28 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 112.41 0.522 . . . . 0.47 112.41 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.5 p -70.51 -50.71 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 O-C-N 122.17 -0.331 . . . . 1.38 110.636 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.0 mtt -56.26 -43.74 79.04 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.065 0.46 . . . . 0.85 111.264 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -53.99 -42.01 68.56 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.373 -0.83 . . . . 1.95 111.872 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.8 m -84.17 -18.72 35.74 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.071 -0.513 . . . . 0.59 111.77 -178.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.6 mp -87.85 -53.16 4.9 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 111.894 0.331 . . . . 0.72 111.894 -178.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -150.55 43.19 0.73 Allowed Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.471 -0.871 . . . . 0.56 112.154 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 71.32 155.45 0.15 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.604 0.716 . . . . 2.83 111.344 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -95.61 134.19 24.57 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.728 -0.669 . . . . 0.96 109.91 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.25 -160.46 0.11 Allowed 'Trans proline' 0 C--O 1.23 0.116 0 C-N-CA 122.824 2.35 . . . . 0.61 111.301 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.1 p -83.63 165.17 19.21 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 109.689 -0.486 . . . . 0.8 109.689 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -64.91 -24.13 67.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 2.13 110.199 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.24 -50.87 62.29 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.313 -0.403 . . . . 0.7 110.859 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -68.11 -33.72 75.05 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.317 0.58 . . . . 0.81 110.199 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.5 tp -68.3 -41.36 81.04 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.732 -0.667 . . . . 0.76 111.424 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.481 ' O ' HG22 ' A' ' 52' ' ' ILE . 23.4 tt0 -67.64 -40.78 84.56 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.876 -0.602 . . . . 1.12 110.792 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -72.6 -27.07 61.94 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.576 -0.45 . . . . 1.42 110.706 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.463 ' O ' HG12 ' A' ' 55' ' ' VAL . 1.1 tmm? -62.91 -38.58 91.53 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.494 -0.321 . . . . 0.54 110.48 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.481 HG22 ' O ' ' A' ' 49' ' ' GLN . 10.3 tp -78.76 -15.82 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 CA-C-O 121.368 0.604 . . . . 0.59 110.062 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -83.98 -27.88 28.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.827 0.822 . . . . 1.06 108.872 178.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.438 ' CD ' ' HG3' ' B' ' 287' ' ' ARG . 0.9 OUTLIER -81.54 14.79 2.36 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.977 -1.01 . . . . 1.58 111.0 -179.629 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.685 HG21 ' CE2' ' B' ' 292' ' ' TRP . 1.4 p -144.24 -41.16 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 116.477 -0.328 . . . . 0.82 111.253 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.642 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 21.5 t70 -77.94 92.19 4.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.653 0.739 . . . . 0.7 110.827 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.53 -29.29 68.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.082 -0.963 . . . . 0.9 112.283 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.96 -39.71 87.32 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 121.053 -0.259 . . . . 0.85 110.484 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 95.12 46.99 2.71 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.953 -0.642 . . . . 1.03 113.249 178.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -137.47 -0.76 2.15 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.432 0.634 . . . . 1.61 110.233 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.89 15.5 69.26 Favored Glycine 0 C--N 1.334 0.459 0 CA-C-N 115.57 -0.741 . . . . 0.67 113.191 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.8 m -134.05 133.82 41.63 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 121.377 0.608 . . . . 0.65 111.373 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.641 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.3 OUTLIER -121.19 118.6 56.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.966 -0.561 . . . . 0.5 109.763 178.974 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -99.06 -172.59 2.31 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 123.743 0.652 . . . . 1.09 109.749 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.484 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 0.4 OUTLIER -51.75 -55.32 31.01 Favored Pre-proline 0 N--CA 1.469 0.494 0 CA-C-O 119.088 -0.482 . . . . 1.78 112.121 -179.659 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 6.0 Cg_endo -49.07 -44.61 32.31 Favored 'Trans proline' 0 C--N 1.354 0.816 0 C-N-CA 122.456 2.104 . . . . 0.79 112.48 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.642 ' OE2' 'CA ' ' A' ' 182' ' ' ' CA' . 21.4 mt-10 -69.34 -47.16 65.2 Favored 'General case' 0 C--O 1.222 -0.348 0 O-C-N 123.881 0.738 . . . . 0.66 110.51 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -59.03 -40.48 85.16 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.049 0.452 . . . . 0.77 111.462 -178.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 97.7 mt -57.23 -35.06 69.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.629 -0.714 . . . . 0.9 111.272 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -87.24 -37.82 16.9 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.279 -0.419 . . . . 1.02 110.903 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.583 ' HE3' ' HA ' ' B' ' 289' ' ' ALA . 11.1 tpt -59.1 -46.97 86.95 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.905 -0.589 . . . . 0.69 111.639 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.69 29.43 1.16 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.666 -0.243 . . . . 0.99 111.267 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -136.46 -49.63 0.66 Allowed 'General case' 0 C--O 1.237 0.415 0 CA-C-O 120.842 0.353 . . . . 1.21 110.357 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.42 90.11 3.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.064 -0.516 . . . . 2.56 109.842 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -99.86 158.05 16.08 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.171 -0.468 . . . . 3.25 110.592 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -81.15 162.63 23.57 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.264 -0.425 . . . . 2.59 110.855 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.7 mttm -98.21 -6.39 31.36 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.192 -0.458 . . . . 2.45 111.922 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -82.82 -175.54 5.85 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.608 -0.515 . . . . 2.35 109.608 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.7 m -95.0 130.15 41.78 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.654 -0.248 . . . . 3.14 110.478 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.02 -0.99 . . . . 3.21 110.221 -179.999 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 287' ' ' ARG . . . . . 0.438 ' HG3' ' CD ' ' A' ' 54' ' ' GLU . 8.4 ttt-85 . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 109.353 -0.61 . . . . 3.11 109.353 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.539 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -59.88 -23.77 63.72 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.049 0.452 . . . . 0.6 111.559 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 289' ' ' ALA . . . . . 0.693 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -67.43 -11.81 58.71 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-O 119.02 -0.514 . . . . 0.65 109.655 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -99.9 -35.32 9.79 Favored 'General case' 0 C--O 1.246 0.915 0 CA-C-O 121.473 0.654 . . . . 0.87 111.086 174.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 291' ' ' LEU . . . . . 0.495 ' O ' ' HG2' ' B' ' 295' ' ' PRO . 7.1 mp -79.73 -8.08 59.02 Favored 'General case' 0 C--O 1.213 -0.868 0 C-N-CA 123.878 0.871 . . . . 1.37 110.416 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.685 ' CE2' HG21 ' A' ' 55' ' ' VAL . 6.1 m0 -92.45 -55.1 0.25 Allowed Pre-proline 0 C--N 1.318 -0.792 0 N-CA-C 108.062 -1.088 . . . . 0.42 108.062 174.044 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.693 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 9.8 Cg_exo -48.51 -38.63 35.92 Favored 'Trans proline' 0 C--N 1.36 1.133 0 C-N-CA 123.337 2.691 . . . . 0.54 112.707 175.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.497 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 5.6 t -61.53 -62.58 5.62 Favored Pre-proline 0 CA--C 1.546 0.817 0 N-CA-C 108.616 -0.883 . . . . 0.95 108.616 178.108 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.497 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 1.0 OUTLIER -46.25 -40.18 21.67 Favored 'Trans proline' 0 C--N 1.361 1.192 0 C-N-CA 123.156 2.571 . . . . 0.54 113.343 174.745 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 13.5 tp -68.86 -37.39 79.07 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.049 0.452 . . . . 0.56 109.968 178.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 27.2 ttt -63.61 -37.6 87.95 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.614 -0.884 . . . . 1.79 108.614 178.108 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 34.3 mm -62.75 -41.21 91.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.113 -0.949 . . . . 0.5 109.073 177.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 299' ' ' LYS . . . . . 0.48 ' CG ' ' HB2' ' A' ' 18' ' ' LEU . 0.2 OUTLIER -62.45 -43.75 98.06 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.452 -0.795 . . . . 0.51 109.753 179.182 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -64.06 -33.98 76.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.295 0.569 . . . . 2.44 110.419 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 39.5 m -69.98 -34.72 73.73 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.621 -0.718 . . . . 0.66 109.245 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -75.98 -28.61 57.93 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 109.423 -0.584 . . . . 2.44 109.423 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -69.97 -35.42 74.45 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.691 -0.855 . . . . 0.82 108.691 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -76.14 -40.02 53.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.189 -0.914 . . . . 1.16 109.104 178.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 6.9 m . . . . . 0 C--O 1.247 0.935 0 CA-C-N 114.848 -1.069 . . . . 1.39 111.763 178.692 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 181' ' ' ' CA' . . . . . 0.653 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 182' ' ' ' CA' . . . . . 0.642 'CA ' ' OD1' ' A' ' 56' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.802 0 CA-C-O 120.897 0.38 . . . . 2.58 110.179 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -73.09 90.74 1.55 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.383 0.611 . . . . 3.47 110.23 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -147.58 -51.57 0.19 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.43 -0.804 . . . . 2.95 109.091 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 33.2 mt -96.39 37.54 1.26 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.369 -0.832 . . . . 1.97 109.853 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -68.23 0.54 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.556 -0.747 . . . . 1.68 110.906 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 43.65 67.66 0.63 Allowed 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.137 0.898 . . . . 1.44 111.593 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.83 -44.5 2.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 1.35 111.484 -179.23 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -89.55 -34.05 16.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.075 0.464 . . . . 1.61 110.391 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 26.7 mt -62.57 -25.5 38.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.81 -0.632 . . . . 1.23 110.018 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.427 ' HA ' ' HE3' ' A' ' 13' ' ' LYS . . . -63.13 -38.63 91.94 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.395 0.617 . . . . 0.98 111.103 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -83.72 -18.36 38.16 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.904 -0.589 . . . . 1.18 110.518 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 18.6 m-30 -75.94 -40.31 54.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.698 -0.683 . . . . 1.27 109.3 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.427 ' HE3' ' HA ' ' A' ' 10' ' ' ALA . 45.5 mtmt -64.79 -26.48 68.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.211 -0.904 . . . . 0.99 109.969 178.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.433 ' HG2' ' HE3' ' B' ' 299' ' ' LYS . 1.8 tp10 -67.37 -23.85 65.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.456 -0.793 . . . . 1.29 110.171 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.654 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -74.35 -37.54 63.49 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 109.793 -0.447 . . . . 0.58 109.793 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -75.26 -2.02 26.14 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.557 -0.457 . . . . 0.98 110.512 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -112.6 -53.56 2.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.965 0.412 . . . . 0.73 111.474 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.445 HD12 ' HG2' ' B' ' 299' ' ' LYS . 74.1 mt -85.76 -42.34 14.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.243 -0.435 . . . . 0.55 111.7 -179.083 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.654 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 82.6 t80 -75.06 -35.31 61.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.304 -0.407 . . . . 0.79 111.259 -177.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.635 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 39.0 t70 -91.96 130.58 37.68 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.844 -0.428 . . . . 0.59 109.844 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.472 ' HZ1' HG23 ' A' ' 35' ' ' VAL . 6.1 mptt -106.14 -9.65 16.84 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.439 0.533 . . . . 1.57 112.439 -178.145 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.643 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 0.0 OUTLIER -91.67 -35.56 14.13 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 111.688 0.255 . . . . 0.82 111.688 -178.076 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.06 0.76 33.75 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 121.184 -0.531 . . . . 0.87 111.815 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -81.33 -27.98 34.73 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.812 0.339 . . . . 0.74 110.576 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.06 -46.07 3.59 Favored Glycine 0 CA--C 1.518 0.249 0 C-N-CA 121.318 -0.468 . . . . 1.3 113.475 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -53.27 123.72 12.65 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.522 0.564 . . . . 0.66 112.522 -179.045 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.575 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 18.0 mt -69.83 119.28 15.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-N 116.254 -0.43 . . . . 0.5 111.32 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.26 168.66 14.44 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 108.9 -0.778 . . . . 0.77 108.9 178.485 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.78 -33.78 64.68 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.817 0.341 . . . . 0.59 111.709 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -60.47 -45.44 93.72 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.353 0.501 . . . . 0.56 112.353 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.662 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 19.4 mp0 -80.37 -23.21 40.62 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-O 121.216 0.531 . . . . 0.87 111.688 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.0 tp -72.06 -50.74 25.86 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.851 -0.613 . . . . 0.47 110.167 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.09 -36.13 79.8 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.787 -0.642 . . . . 0.36 113.939 -179.005 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -55.7 -32.71 63.54 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 117.677 0.738 . . . . 0.47 112.385 -178.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.472 HG23 ' HZ1' ' A' ' 21' ' ' LYS . 99.0 t -77.53 -51.61 17.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.233 -0.587 . . . . 1.38 109.955 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 52.6 mtt -59.0 -32.81 70.02 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.924 -0.58 . . . . 0.85 111.841 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.1 ttt180 -58.43 -40.45 82.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.45 -0.341 . . . . 1.95 111.789 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.1 m -97.29 -6.65 33.92 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.112 0.482 . . . . 0.59 110.645 -178.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 16.2 tp -87.06 -47.74 8.67 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.911 -0.586 . . . . 0.72 110.167 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -161.48 47.47 0.37 Allowed Glycine 0 C--N 1.335 0.479 0 C-N-CA 120.45 -0.881 . . . . 0.56 112.634 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 69.98 140.23 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.508 0.671 . . . . 2.83 111.476 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -99.36 136.51 20.4 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.029 -0.532 . . . . 0.96 110.587 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.61 -163.74 0.22 Allowed 'Trans proline' 0 C--O 1.24 0.575 0 C-N-CA 122.898 2.398 . . . . 0.61 112.063 179.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 73.0 p -73.64 163.9 27.38 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.355 -0.609 . . . . 0.8 109.355 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -68.18 -29.13 67.92 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.914 0.387 . . . . 2.13 110.181 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.37 -49.76 72.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.946 -0.57 . . . . 0.7 110.422 178.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -63.54 -35.42 80.44 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.909 -0.587 . . . . 0.81 110.644 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.0 tp -70.07 -34.55 73.33 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.949 -0.569 . . . . 0.76 110.182 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.506 ' O ' HG22 ' A' ' 52' ' ' ILE . 15.8 tt0 -68.11 -39.91 82.67 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.545 -0.539 . . . . 1.12 109.545 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -61.02 -29.84 69.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.557 0.694 . . . . 1.42 109.722 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.0 mmm -65.43 -43.27 90.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.353 -0.84 . . . . 0.54 111.946 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.506 HG22 ' O ' ' A' ' 49' ' ' GLN . 4.8 tp -71.73 -18.33 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 CA-C-O 120.985 0.422 . . . . 0.59 111.355 -178.748 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -81.06 -25.02 37.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.625 0.726 . . . . 1.06 110.577 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.413 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 13.1 tt0 -93.51 8.26 41.35 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.325 -0.852 . . . . 1.58 111.046 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.795 ' HB ' ' HB3' ' B' ' 288' ' ' ALA . 8.5 p -142.85 25.86 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.806 0.812 . . . . 0.82 112.701 -177.032 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.635 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 30.5 t70 -146.65 95.53 2.61 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.683 0.754 . . . . 0.7 109.709 178.511 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.24 -29.98 70.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.334 -0.848 . . . . 0.9 112.047 -178.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.48 -16.02 62.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.998 0.428 . . . . 0.85 111.068 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.77 41.73 95.56 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 121.147 -0.549 . . . . 1.03 113.669 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -120.7 -19.96 7.21 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.955 0.407 . . . . 1.61 110.587 179.189 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 86.12 27.89 29.76 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 115.89 -0.595 . . . . 0.67 112.578 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.3 m -154.78 142.88 20.24 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 121.365 0.602 . . . . 0.65 110.963 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.518 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 1.4 mt -123.35 113.71 38.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.696 -0.684 . . . . 0.5 109.787 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -87.06 -171.0 3.3 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.455 -0.793 . . . . 1.09 110.285 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.504 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 3.9 m-85 -58.48 -53.4 66.53 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 116.004 -0.544 . . . . 1.78 111.536 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.504 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.6 Cg_endo -55.17 -38.69 93.44 Favored 'Trans proline' 0 C--N 1.361 1.214 0 C-N-CA 122.274 1.982 . . . . 0.79 112.85 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.65 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 38.2 mt-10 -68.38 -44.94 74.05 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.222 0.534 . . . . 0.66 111.154 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -58.2 -29.77 65.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.235 -0.893 . . . . 0.77 112.135 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 80.4 mt -61.82 -27.3 68.67 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-N 116.41 -0.359 . . . . 0.9 111.427 179.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -106.62 -26.92 11.15 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.894 -0.322 . . . . 1.02 111.215 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.615 ' HG3' ' SD ' ' A' ' 72' ' ' MET . 10.5 tpt -49.82 -52.02 35.42 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.298 0.481 . . . . 0.69 112.298 -179.264 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.615 ' SD ' ' HG3' ' A' ' 71' ' ' MET . 0.3 OUTLIER -94.04 17.65 12.04 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.274 0.472 . . . . 0.99 112.274 -178.83 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -110.39 -41.57 4.34 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.885 0.374 . . . . 1.21 111.21 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -93.9 85.65 4.84 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.917 -0.401 . . . . 2.56 109.917 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -102.64 179.26 4.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.952 0.406 . . . . 3.25 111.488 -179.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 71.7 mtp -82.22 172.96 12.55 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.184 0.516 . . . . 2.59 111.071 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -102.69 -28.57 12.04 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.135 -0.484 . . . . 2.45 110.467 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -63.63 143.62 57.68 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.164 -0.471 . . . . 2.35 110.881 -179.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.6 m -70.01 119.73 14.66 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.999 -0.546 . . . . 3.14 111.088 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.254 1.32 0 CA-C-O 118.448 -0.787 . . . . 3.21 109.874 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 287' ' ' ARG . . . . . 0.435 HH11 ' HD2' ' B' ' 287' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 110.02 -0.363 . . . . 3.11 110.02 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.795 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -58.58 -24.15 60.23 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-O 120.99 0.424 . . . . 0.6 110.517 178.584 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 289' ' ' ALA . . . . . 0.57 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -68.97 -14.54 63.1 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 115.733 -0.667 . . . . 0.65 111.002 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 290' ' ' ASN . . . . . 0.4 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 8.2 m-80 -96.14 -39.88 9.48 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 109.092 -0.707 . . . . 0.87 109.092 175.211 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 291' ' ' LEU . . . . . 0.78 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 1.2 mp -64.53 -42.54 95.69 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 115.212 -0.903 . . . . 1.37 109.385 178.612 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.575 ' CZ3' HD12 ' A' ' 27' ' ' ILE . 4.4 m0 -56.56 -57.28 24.49 Favored Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 108.307 -0.998 . . . . 0.42 108.307 177.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.57 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 7.0 Cg_exo -50.06 -24.71 11.41 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.844 2.362 . . . . 0.54 113.759 175.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.499 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 50.6 m -60.44 -68.39 0.79 Allowed Pre-proline 0 CA--C 1.544 0.715 0 CA-C-O 118.484 -0.769 . . . . 0.95 109.585 178.142 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.78 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 69.6 Cg_exo -48.88 -38.32 38.09 Favored 'Trans proline' 0 C--N 1.371 1.72 0 C-N-CA 121.88 1.72 . . . . 0.54 112.629 175.094 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.516 ' O ' ' HG3' ' B' ' 300' ' ' ARG . 19.6 tp -61.39 -37.93 85.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.161 -0.472 . . . . 0.56 110.011 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 6.2 ttt -67.16 -39.69 86.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.818 -0.628 . . . . 1.79 109.46 178.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 43.6 mm -64.73 -39.63 86.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.646 0.736 . . . . 0.5 109.057 178.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 299' ' ' LYS . . . . . 0.523 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.1 OUTLIER -62.68 -40.84 98.36 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.905 -1.043 . . . . 0.51 109.119 178.011 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 300' ' ' ARG . . . . . 0.516 ' HG3' ' O ' ' B' ' 296' ' ' LEU . 30.3 mtp180 -63.29 -44.79 94.05 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.734 -0.666 . . . . 2.44 109.898 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 50.7 m -59.95 -37.83 80.69 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.71 -0.677 . . . . 0.66 110.109 178.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.2 tptp -73.25 -38.31 66.03 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 110.09 -0.337 . . . . 2.44 110.09 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -64.83 -28.48 69.58 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.603 0.716 . . . . 0.82 109.638 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -81.46 -30.99 33.2 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.142 -0.935 . . . . 1.16 109.636 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 13.0 m . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.304 -0.855 . . . . 1.39 112.294 179.112 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 181' ' ' ' CA' . . . . . 0.662 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 182' ' ' ' CA' . . . . . 0.65 'CA ' ' OE1' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.465 ' HB3' ' OE1' ' A' ' 3' ' ' GLN . . . . . . . . 0 N--CA 1.486 1.353 0 N-CA-C 110.006 -0.368 . . . . 2.58 110.006 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -79.02 86.41 4.88 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-O 121.33 0.586 . . . . 3.47 109.879 178.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.465 ' OE1' ' HB3' ' A' ' 1' ' ' ALA . 6.1 mp0 -124.97 -65.62 1.02 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.564 -0.744 . . . . 2.95 109.29 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 mt -105.73 67.34 0.75 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.66 -0.7 . . . . 1.97 110.117 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.8 -76.65 0.16 Allowed 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.22 -0.9 . . . . 1.68 109.686 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 38.13 69.26 0.26 Allowed 'General case' 0 CA--C 1.532 0.251 0 O-C-N 124.306 1.004 . . . . 1.44 112.658 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.88 -56.37 1.19 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.944 -0.571 . . . . 1.35 110.699 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -79.5 -41.67 26.92 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.232 -0.655 . . . . 1.61 109.232 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.429 ' H ' HG13 ' A' ' 9' ' ' ILE . 5.7 mt -57.45 -24.7 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 114.785 -1.098 . . . . 1.23 111.926 -179.239 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.07 -31.44 72.66 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 120.791 0.329 . . . . 0.98 111.58 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.91 -21.58 29.62 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.04 0.448 . . . . 1.18 110.475 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -76.51 -32.08 58.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.98 -0.555 . . . . 1.27 110.032 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -72.09 -15.45 62.01 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.171 0.51 . . . . 0.99 110.679 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.417 ' HG3' ' CD1' ' A' ' 18' ' ' LEU . 3.0 tp10 -72.45 -26.05 61.68 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.907 -0.588 . . . . 1.29 110.386 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.588 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -66.73 -43.09 85.12 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.163 -0.471 . . . . 0.58 110.78 -178.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -80.65 5.32 15.89 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.367 -0.379 . . . . 0.98 110.871 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.3 m -112.74 -41.28 3.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.73 112.075 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.634 HD12 ' HG2' ' B' ' 299' ' ' LYS . 18.2 mt -103.49 -44.15 5.2 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.438 0.532 . . . . 0.55 112.438 -178.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.588 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 83.1 t80 -62.59 -34.23 76.58 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.247 0.546 . . . . 0.79 110.435 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.652 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 35.0 t70 -93.95 138.63 31.86 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.688 -0.687 . . . . 0.59 110.139 178.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -124.52 32.62 5.43 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.257 -0.277 . . . . 1.57 110.989 -179.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.622 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 0.1 OUTLIER -131.61 -31.14 1.59 Allowed 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.641 -0.424 . . . . 0.82 111.195 -179.207 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.73 18.65 17.6 Favored Glycine 0 CA--C 1.505 -0.562 0 N-CA-C 111.045 -0.822 . . . . 0.87 111.045 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -97.36 -32.17 12.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.294 -0.453 . . . . 0.74 110.596 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 69.13 31.6 72.2 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 120.922 -0.656 . . . . 1.3 113.707 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.82 138.07 53.29 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 117.909 0.854 . . . . 0.66 110.675 179.17 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 28.6 mt -81.8 111.46 18.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-O 121.089 0.471 . . . . 0.5 111.219 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -128.11 170.18 13.23 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.353 -0.84 . . . . 0.77 109.319 178.458 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.84 -31.74 59.8 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.18 0.514 . . . . 0.59 112.217 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.2 tttt -62.11 -45.53 93.06 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.273 0.559 . . . . 0.56 112.212 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.665 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 39.5 mp0 -79.22 -20.95 47.0 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.896 -0.593 . . . . 0.87 111.162 -178.245 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.414 HD21 ' CE ' ' A' ' 51' ' ' MET . 23.5 tp -80.0 -47.39 15.01 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.428 -0.806 . . . . 0.47 110.602 -179.514 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.14 -37.12 72.34 Favored Glycine 0 CA--C 1.512 -0.145 0 CA-C-N 115.429 -0.805 . . . . 0.36 113.289 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 p -57.12 -28.1 62.39 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.983 0.392 . . . . 0.47 111.89 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 93.5 t -77.07 -56.28 8.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 120.881 -0.328 . . . . 1.38 110.616 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 51.3 mtt -57.69 -37.72 73.95 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.447 -0.342 . . . . 0.85 110.872 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -55.12 -42.18 72.64 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.755 -0.657 . . . . 1.95 111.366 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.8 m -89.58 -19.48 24.92 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.842 0.354 . . . . 0.59 111.786 -178.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.3 tp -79.9 -36.87 35.82 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 112.14 0.422 . . . . 0.72 112.14 -179.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.13 43.81 0.14 Allowed Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.702 -0.761 . . . . 0.56 112.454 -178.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 70.85 147.49 0.07 Allowed 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.77 0.795 . . . . 2.83 111.936 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -102.64 134.8 19.69 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.644 -0.707 . . . . 0.96 109.819 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.7 -161.2 0.11 Allowed 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.475 2.117 . . . . 0.61 112.514 179.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.5 p -76.43 162.16 28.08 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.535 -0.302 . . . . 0.8 110.319 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.431 ' CD ' ' H ' ' A' ' 45' ' ' GLU . 2.9 mp0 -61.92 -31.03 71.31 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 116.676 -0.238 . . . . 2.13 111.199 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.72 -49.21 77.37 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.144 0.497 . . . . 0.7 110.312 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -66.52 -35.12 79.47 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.054 -0.521 . . . . 0.81 110.877 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 21.2 tp -71.61 -34.54 69.94 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.642 -0.708 . . . . 0.76 111.217 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.404 ' O ' HG22 ' A' ' 52' ' ' ILE . 21.4 tt0 -71.55 -39.28 70.78 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.697 -0.483 . . . . 1.12 109.697 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -60.04 -32.38 70.85 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.562 -0.745 . . . . 1.42 109.909 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.414 ' CE ' HD21 ' A' ' 32' ' ' LEU . 1.8 mmm -62.22 -45.98 90.94 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.196 -0.911 . . . . 0.54 110.66 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.638 ' HA ' HG12 ' A' ' 55' ' ' VAL . 6.1 tp -75.98 -18.49 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 C-N-CA 120.71 -0.396 . . . . 0.59 111.41 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -78.96 -20.09 50.05 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.298 0.571 . . . . 1.06 110.269 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.502 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 14.4 tt0 -99.08 9.5 43.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.564 -0.744 . . . . 1.58 111.706 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.769 ' HB ' ' CB ' ' B' ' 288' ' ' ALA . 9.5 p -137.6 -13.07 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-O 121.227 0.537 . . . . 0.82 112.34 -176.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.604 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 26.9 t70 -109.49 98.48 7.86 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.74 -0.837 . . . . 0.7 108.74 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.0 -22.18 61.46 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 115.957 -0.565 . . . . 0.9 111.936 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.42 -24.28 57.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.155 0.502 . . . . 0.85 110.529 178.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 75.8 29.04 59.87 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.926 -0.654 . . . . 1.03 113.219 178.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -108.05 -22.17 12.51 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.137 -0.69 . . . . 1.61 109.137 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.99 -2.71 64.14 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.846 -0.693 . . . . 0.67 113.526 178.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.3 m -128.13 153.51 46.78 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-O 121.289 0.566 . . . . 0.65 111.526 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.612 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.5 OUTLIER -132.57 122.76 48.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.628 -0.715 . . . . 0.5 110.317 179.515 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -96.11 -171.17 2.26 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 123.709 0.631 . . . . 1.09 110.503 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.516 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 4.8 m-85 -54.18 -55.09 40.39 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 123.801 0.84 . . . . 1.78 111.422 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 10.1 Cg_endo -53.33 -42.68 63.45 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 122.937 2.425 . . . . 0.79 111.845 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.615 ' OE2' 'CA ' ' A' ' 182' ' ' ' CA' . 23.5 mt-10 -65.47 -48.94 70.95 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.216 -0.902 . . . . 0.66 109.68 178.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -56.67 -43.93 80.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.316 0.579 . . . . 0.77 110.367 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.4 mt -55.56 -31.86 62.52 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.177 -0.92 . . . . 0.9 111.72 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.3 m -94.61 -38.28 10.93 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.921 0.391 . . . . 1.02 111.263 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.437 ' HE1' HG23 ' A' ' 55' ' ' VAL . 12.4 tpt -61.26 -59.24 5.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.992 -0.549 . . . . 0.69 111.937 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.405 ' SD ' ' HG3' ' A' ' 71' ' ' MET . 0.1 OUTLIER -77.93 31.98 0.17 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.4 -0.364 . . . . 0.99 111.437 -179.064 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.407 ' H ' ' C ' ' A' ' 71' ' ' MET . . . -136.69 -22.32 1.25 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.171 -0.468 . . . . 1.21 111.604 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -99.89 98.29 9.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.255 0.55 . . . . 2.56 111.437 -179.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 53.1 pttt -91.52 -178.95 5.24 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.85 -0.614 . . . . 3.25 110.374 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 2.8 tpp -126.63 -174.71 3.2 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 110.123 -0.325 . . . . 2.59 110.123 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -109.6 34.1 3.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.559 0.695 . . . . 2.45 109.538 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -90.1 -167.53 1.87 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.93 -1.032 . . . . 2.35 111.164 -177.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 20.4 m -121.75 123.15 41.16 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.191 0.52 . . . . 3.14 110.623 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.776 -0.63 . . . . 3.21 110.449 -179.555 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 287' ' ' ARG . . . . . 0.502 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 120.906 0.384 . . . . 3.11 110.146 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.769 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -57.86 -25.01 60.14 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 116.12 -0.491 . . . . 0.6 112.3 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 289' ' ' ALA . . . . . 0.4 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -69.94 -1.72 10.42 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 113.24 0.83 . . . . 0.65 113.24 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 290' ' ' ASN . . . . . 0.472 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 7.3 m120 -112.11 -30.77 7.11 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.303 0.573 . . . . 0.87 109.477 176.409 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 291' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' B' ' 291' ' ' LEU . 33.0 mt -80.92 -6.02 58.17 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 114.879 -1.055 . . . . 1.37 109.809 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.612 ' CH2' HD12 ' A' ' 63' ' ' ILE . 1.7 m0 -92.13 -53.23 0.27 Allowed Pre-proline 0 CA--C 1.543 0.7 0 N-CA-C 107.589 -1.263 . . . . 0.42 107.589 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.472 ' HD2' ' C ' ' B' ' 290' ' ' ASN . 13.3 Cg_exo -51.68 -36.3 60.84 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 123.05 2.5 . . . . 0.54 112.921 175.193 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.493 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 2.7 t -58.98 -61.45 7.79 Favored Pre-proline 0 CA--C 1.548 0.885 0 CA-C-O 119.282 -0.389 . . . . 0.95 111.063 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.493 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 88.4 Cg_exo -53.12 -33.09 62.23 Favored 'Trans proline' 0 C--N 1.358 1.058 0 C-N-CA 122.691 2.261 . . . . 0.54 112.596 178.191 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 15.5 tp -68.02 -35.37 78.18 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.126 0.489 . . . . 0.56 110.091 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 16.7 ttt -70.34 -38.43 74.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.23 -0.896 . . . . 1.79 108.699 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 298' ' ' ILE . . . . . 0.407 HG12 ' O ' ' B' ' 294' ' ' SER . 48.9 mm -61.74 -38.37 80.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 108.211 -1.033 . . . . 0.5 108.211 177.089 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 299' ' ' LYS . . . . . 0.634 ' HG2' HD12 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -59.99 -39.97 87.56 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.308 -0.627 . . . . 0.51 109.308 177.451 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -64.89 -41.15 95.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.55 -0.75 . . . . 2.44 110.414 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 19.4 m -63.45 -35.88 81.91 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.738 -0.664 . . . . 0.66 109.595 178.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 14.3 tptp -76.28 -30.21 57.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.066 -0.515 . . . . 2.44 109.736 179.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 9.4 tttp -68.71 -34.58 75.88 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.806 -0.812 . . . . 0.82 108.806 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -76.01 -40.34 53.78 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.568 -1.196 . . . . 1.16 110.08 179.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.668 -0.682 . . . . 1.39 111.455 179.575 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 181' ' ' ' CA' . . . . . 0.665 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 182' ' ' ' CA' . . . . . 0.615 'CA ' ' OE2' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.407 ' HB3' ' OE1' ' A' ' 3' ' ' GLN . . . . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 110.049 -0.352 . . . . 2.58 110.049 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -74.01 72.44 1.64 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.333 0.587 . . . . 3.47 110.85 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.407 ' OE1' ' HB3' ' A' ' 1' ' ' ALA . 2.2 mp0 -106.6 -43.84 4.63 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.518 -0.765 . . . . 2.95 110.283 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.2 mt -112.44 77.31 1.03 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.575 -0.738 . . . . 1.97 110.987 -178.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.13 -53.38 4.14 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.987 -0.551 . . . . 1.68 110.579 179.563 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 54.81 63.54 2.11 Favored 'General case' 0 C--O 1.224 -0.248 0 O-C-N 123.715 0.635 . . . . 1.44 111.145 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.92 -55.45 2.49 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.641 -0.424 . . . . 1.35 111.626 -178.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -94.27 -24.58 17.39 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.062 0.458 . . . . 1.61 109.953 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.428 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 6.5 mt -65.18 -23.05 32.42 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-N 115.95 -0.568 . . . . 1.23 110.581 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.61 -26.55 64.5 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.871 -0.332 . . . . 0.98 111.268 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -92.76 -12.69 30.63 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 120.866 0.365 . . . . 1.18 111.32 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -80.46 -37.54 31.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.145 0.498 . . . . 1.27 109.802 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 81.8 mttt -61.64 -22.69 65.49 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.507 0.67 . . . . 0.99 111.206 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.504 ' CG ' ' HE3' ' B' ' 299' ' ' LYS . 1.3 tp10 -70.88 -22.0 62.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.387 -0.824 . . . . 1.29 112.076 -177.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.697 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -70.18 -36.31 74.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.181 0.515 . . . . 0.58 110.647 179.034 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.422 ' HB3' ' HA3' ' A' ' 25' ' ' GLY . 10.5 m-85 -86.19 16.55 4.25 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.022 -0.535 . . . . 0.98 109.665 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.6 m -125.56 -56.58 1.49 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.886 -0.597 . . . . 0.73 112.202 -178.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.494 ' HB2' ' CG ' ' B' ' 299' ' ' LYS . 13.6 mt -96.1 -30.56 13.47 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.255 0.465 . . . . 0.55 112.255 -178.108 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.697 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 46.5 t80 -73.92 -34.03 64.2 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.062 0.458 . . . . 0.79 110.096 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.646 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 24.2 t70 -91.22 140.69 29.56 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.685 -0.689 . . . . 0.59 109.605 179.248 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -114.74 6.55 15.63 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.579 0.585 . . . . 1.57 112.579 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.639 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 0.0 OUTLIER -104.62 -53.86 2.62 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.419 -0.512 . . . . 0.82 110.942 -178.974 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 139.44 4.38 1.46 Allowed Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.827 -0.701 . . . . 0.87 112.34 -178.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.93 -58.15 2.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.974 0.416 . . . . 0.74 110.017 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.422 ' HA3' ' HB3' ' A' ' 16' ' ' PHE . . . 111.84 -29.95 8.13 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.798 -0.637 . . . . 1.3 111.556 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.85 130.22 40.28 Favored 'General case' 0 C--N 1.323 -0.549 0 O-C-N 123.925 0.427 . . . . 0.66 111.859 -179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.579 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 24.1 mt -78.79 108.45 12.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 116.107 -0.497 . . . . 0.5 110.615 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.91 170.9 9.34 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 108.49 -0.93 . . . . 0.77 108.49 177.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.473 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -57.58 -31.69 66.42 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 111.679 0.252 . . . . 0.59 111.679 -179.54 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.9 tttt -63.8 -44.96 91.76 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.066 0.395 . . . . 0.56 112.066 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.666 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 25.2 mp0 -79.97 -21.81 43.31 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 111.742 0.275 . . . . 0.87 111.742 -178.299 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.605 HD21 ' HE2' ' A' ' 51' ' ' MET . 18.1 tp -79.53 -46.62 17.01 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.083 -0.508 . . . . 0.47 110.77 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.82 -36.32 86.74 Favored Glycine 0 N--CA 1.453 -0.212 0 CA-C-N 115.851 -0.613 . . . . 0.36 113.104 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.71 -31.05 67.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.771 0.286 . . . . 0.47 111.351 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 67.0 t -73.23 -56.55 9.18 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 N-CA-C 109.265 -0.643 . . . . 1.38 109.265 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 59.9 mtt -52.15 -46.9 65.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.121 -0.945 . . . . 0.85 111.134 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -57.28 -38.02 73.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.433 -0.803 . . . . 1.95 111.3 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.0 m -95.41 14.18 23.42 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.102 -0.499 . . . . 0.59 111.671 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.8 tp -122.03 -43.1 2.35 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.536 0.208 . . . . 0.72 110.916 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -164.24 49.93 0.29 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.618 -0.801 . . . . 0.56 112.599 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 72.35 146.07 0.08 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.517 0.727 . . . . 2.83 111.707 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -87.2 140.55 32.44 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.453 -0.794 . . . . 0.96 109.88 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -77.91 -172.96 1.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.271 1.981 . . . . 0.61 111.388 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.7 p -81.76 160.33 23.63 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.935 -0.765 . . . . 0.8 108.935 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -55.16 -32.92 62.52 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.059 0.392 . . . . 2.13 112.059 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.41 -52.34 58.68 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.224 -0.444 . . . . 0.7 110.829 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -64.01 -34.03 77.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.439 . . . . 0.81 110.839 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.473 ' HG ' HG22 ' A' ' 29' ' ' THR . 15.3 tp -63.73 -47.15 82.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.256 -0.429 . . . . 0.76 110.346 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -69.97 -33.39 72.02 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 116.353 -0.385 . . . . 1.12 111.459 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -71.78 -26.8 62.58 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.318 0.58 . . . . 1.42 110.157 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.605 ' HE2' HD21 ' A' ' 32' ' ' LEU . 1.8 mmm -61.95 -42.25 98.9 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.462 -0.79 . . . . 0.54 110.859 178.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.471 ' HA ' HG12 ' A' ' 55' ' ' VAL . 5.4 tp -76.87 -14.67 14.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-O 121.164 0.507 . . . . 0.59 110.278 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.5 t30 -78.37 -22.15 48.35 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.686 0.755 . . . . 1.06 109.054 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.622 ' OE2' ' HA ' ' B' ' 287' ' ' ARG . 2.4 tt0 -98.25 22.52 9.47 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.417 -0.811 . . . . 1.58 111.047 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.741 ' HB ' ' CB ' ' B' ' 288' ' ' ALA . 9.1 p -154.07 -36.65 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.205 0 N-CA-C 113.627 0.973 . . . . 0.82 113.627 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.629 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 28.9 t70 -89.77 91.18 8.53 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.243 -0.583 . . . . 0.7 109.524 179.089 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.36 -24.91 67.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.197 -0.91 . . . . 0.9 113.364 -178.128 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -75.58 -10.95 59.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.93 0.395 . . . . 0.85 110.66 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.08 48.59 68.98 Favored Glycine 0 CA--C 1.519 0.312 0 CA-C-N 116.077 -0.51 . . . . 1.03 114.128 178.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -128.87 -27.79 2.5 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.198 0.523 . . . . 1.61 110.027 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.73 17.88 36.97 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.78 -0.645 . . . . 0.67 113.2 178.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 2.0 m -141.75 139.99 32.98 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.886 0.343 . . . . 0.65 110.808 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.669 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.9 OUTLIER -124.56 118.92 54.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.119 0.485 . . . . 0.5 111.202 179.879 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -93.01 -167.14 1.67 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.368 -0.833 . . . . 1.09 110.472 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.48 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 28.3 m-85 -57.97 -53.32 67.0 Favored Pre-proline 0 CA--C 1.54 0.592 0 C-N-CA 122.936 0.494 . . . . 1.78 112.292 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.3 Cg_endo -57.53 -36.44 98.66 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.991 1.794 . . . . 0.79 112.026 179.353 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.638 ' OE2' 'CA ' ' A' ' 182' ' ' ' CA' . 31.1 mt-10 -72.14 -39.48 68.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.526 -0.761 . . . . 0.66 110.943 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -66.12 -37.47 85.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.245 -0.434 . . . . 0.77 109.835 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.606 ' O ' ' HB3' ' A' ' 73' ' ' ALA . 35.8 mt -63.71 -32.64 74.2 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.817 -0.629 . . . . 0.9 110.286 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.5 m -92.31 11.07 27.13 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.95 -0.568 . . . . 1.02 110.644 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.7 tpt -119.15 -68.25 0.93 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.369 -0.378 . . . . 0.69 111.181 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -17.68 63.39 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.735 0.303 . . . . 0.99 111.727 -178.454 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.606 ' HB3' ' O ' ' A' ' 69' ' ' LEU . . . -104.06 9.47 36.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.918 0.39 . . . . 1.21 110.459 179.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -128.88 37.52 4.07 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.27 -0.423 . . . . 2.56 111.833 -178.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -67.3 157.74 33.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.075 0.464 . . . . 3.25 110.379 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 2.6 mpp? -93.33 156.03 17.05 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.118 -0.492 . . . . 2.59 111.89 -178.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 31.6 mttt -84.89 63.06 7.84 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.89 -0.595 . . . . 2.45 110.211 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -114.44 -164.75 0.95 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.427 -0.806 . . . . 2.35 109.54 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.72 90.54 5.02 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 120.975 0.417 . . . . 3.14 110.687 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.764 -0.636 . . . . 3.21 111.042 -179.878 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 287' ' ' ARG . . . . . 0.622 ' HA ' ' OE2' ' A' ' 54' ' ' GLU . 1.7 tpm_? . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 109.441 -0.578 . . . . 3.11 109.441 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.741 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -61.4 -28.16 69.05 Favored 'General case' 0 C--O 1.214 -0.815 0 N-CA-C 113.295 0.85 . . . . 0.6 113.295 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 289' ' ' ALA . . . . . 0.548 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -70.59 1.3 5.36 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.03 0.752 . . . . 0.65 113.03 -179.343 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -115.95 -37.28 3.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 122.847 1.308 . . . . 0.87 109.431 176.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 25.6 mt -80.52 -7.14 59.09 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 113.245 -1.798 . . . . 1.37 110.662 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.682 ' CE2' HG21 ' A' ' 55' ' ' VAL . 5.0 m0 -93.81 -53.88 0.24 Allowed Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 107.355 -1.35 . . . . 0.42 107.355 174.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.548 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 21.5 Cg_exo -50.94 -37.11 55.58 Favored 'Trans proline' 0 C--N 1.367 1.508 0 C-N-CA 122.578 2.185 . . . . 0.54 113.029 175.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 294' ' ' SER . . . . . . . . . . . . . 1.4 t -59.67 -60.82 9.34 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-O 119.34 -0.362 . . . . 0.95 110.346 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.407 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 85.2 Cg_exo -51.14 -38.4 60.36 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 122.203 1.935 . . . . 0.54 112.091 176.317 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 9.5 tp -64.65 -36.73 85.21 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.824 0.345 . . . . 0.56 110.345 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 17.5 ttt -66.43 -41.66 88.87 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.499 0.666 . . . . 1.79 109.285 177.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 20.4 mm -62.93 -35.6 72.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 108.447 -0.946 . . . . 0.5 108.447 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 299' ' ' LYS . . . . . 0.504 ' HE3' ' CG ' ' A' ' 14' ' ' GLU . 0.2 OUTLIER -66.35 -40.86 90.08 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.88 -1.054 . . . . 0.51 109.381 178.08 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 73.1 mtt180 -63.34 -40.01 96.11 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.198 -0.455 . . . . 2.44 110.101 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 66.2 m -64.71 -42.78 95.01 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.842 -0.617 . . . . 0.66 109.782 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -69.06 -36.9 78.18 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.119 -0.491 . . . . 2.44 110.561 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 3.3 tttp -63.81 -33.08 74.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.815 0.817 . . . . 0.82 109.197 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -81.61 -21.76 38.1 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.699 -1.137 . . . . 1.16 110.81 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.251 1.161 0 CA-C-O 118.575 -0.726 . . . . 1.39 110.265 179.083 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 181' ' ' ' CA' . . . . . 0.666 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 182' ' ' ' CA' . . . . . 0.638 'CA ' ' OE2' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.183 0 N-CA-C 110.51 -0.182 . . . . 2.58 110.51 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -78.06 57.8 1.86 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.062 0.458 . . . . 3.47 111.568 -178.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 -104.31 -41.52 5.75 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.559 0.695 . . . . 2.95 109.206 178.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 34.2 mt -100.8 60.95 0.97 Allowed 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 114.863 -1.062 . . . . 1.97 109.431 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.492 ' HB ' ' H ' ' A' ' 6' ' ' GLU . 1.3 m -70.76 -93.39 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.105 -0.952 . . . . 1.68 111.643 -179.621 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.492 ' H ' ' HB ' ' A' ' 5' ' ' THR . 50.3 mm-40 42.29 56.19 3.75 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.177 0.806 . . . . 1.44 113.177 179.519 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.12 -49.24 2.79 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.834 0.349 . . . . 1.35 111.188 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -104.36 -26.28 12.51 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 109.68 -0.489 . . . . 1.61 109.68 179.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mt -57.32 -27.73 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 115.491 -0.777 . . . . 1.23 110.373 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.24 -42.07 99.17 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.528 -0.76 . . . . 0.98 110.936 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -77.6 -17.27 57.97 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.168 -0.469 . . . . 1.18 111.265 -178.439 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -82.45 -38.4 24.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 1.27 110.445 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.419 ' HA ' ' CE2' ' A' ' 16' ' ' PHE . 38.2 mtmt -69.62 -13.9 62.55 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.372 0.606 . . . . 0.99 110.335 179.049 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -73.19 -17.06 61.4 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.277 -0.874 . . . . 1.29 110.696 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.638 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -69.9 -32.82 71.34 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.341 0.591 . . . . 0.58 110.377 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.419 ' CE2' ' HA ' ' A' ' 13' ' ' LYS . 12.6 m-85 -79.92 5.33 14.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.856 -0.611 . . . . 0.98 111.505 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -124.94 -47.56 1.79 Allowed 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 121.049 -0.261 . . . . 0.73 110.99 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.417 ' HB2' ' CG ' ' B' ' 299' ' ' LYS . 35.8 mt -93.22 -38.96 11.27 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 111.866 0.321 . . . . 0.55 111.866 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.638 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 92.0 t80 -74.4 -42.15 59.73 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.861 0.362 . . . . 0.79 110.898 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -87.31 136.56 32.89 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.286 -0.416 . . . . 0.59 110.671 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -106.35 -11.63 15.92 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.145 0.424 . . . . 1.57 112.145 -178.297 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.628 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 0.0 OUTLIER -90.87 -40.76 11.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.155 0.502 . . . . 0.82 110.655 -179.114 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.07 16.72 15.82 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 110.922 -0.871 . . . . 0.87 110.922 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.656 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 5.0 p-10 -96.86 -21.42 17.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.892 0.377 . . . . 0.74 111.02 -179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.8 -46.11 3.41 Favored Glycine 0 C--O 1.227 -0.291 0 C-N-CA 121.085 -0.579 . . . . 1.3 114.269 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.39 129.84 29.64 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 117.046 0.423 . . . . 0.66 111.622 -179.188 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.405 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 54.4 mt -83.73 115.79 26.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-O 121.362 0.601 . . . . 0.5 111.838 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -126.49 171.86 10.7 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 114.884 -1.053 . . . . 0.77 109.861 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.509 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -57.09 -27.68 61.97 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.742 0.645 . . . . 0.59 112.742 179.405 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -68.1 -39.09 82.91 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.173 0.435 . . . . 0.56 112.173 -178.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.663 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 20.1 mp0 -84.92 -19.22 32.56 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 121.957 -0.464 . . . . 0.87 110.96 -178.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.474 HD21 ' CE ' ' A' ' 51' ' ' MET . 20.4 tp -79.13 -41.2 29.1 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.894 -0.594 . . . . 0.47 110.237 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.33 -28.46 55.68 Favored Glycine 0 C--O 1.226 -0.372 0 C-N-CA 120.946 -0.645 . . . . 0.36 113.843 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.83 -25.66 68.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 117.419 0.61 . . . . 0.47 111.288 -179.116 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.2 t -80.31 -55.69 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 N-CA-C 109.573 -0.528 . . . . 1.38 109.573 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 33.7 mtt -54.47 -39.62 67.65 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.149 0.499 . . . . 0.85 111.035 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -62.4 -38.44 89.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.576 -0.738 . . . . 1.95 111.867 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.2 m -93.12 2.45 56.71 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.078 0.466 . . . . 0.59 111.796 -177.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.0 tp -109.35 -57.91 2.1 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.835 -0.621 . . . . 0.72 110.773 -179.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -145.8 44.61 0.85 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 119.988 -1.101 . . . . 0.56 113.323 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 73.08 140.62 0.06 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.68 0.752 . . . . 2.83 111.834 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -81.68 138.05 47.43 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.384 -0.825 . . . . 0.96 110.496 -179.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.72 -165.55 0.3 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.804 2.336 . . . . 0.61 112.862 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 68.6 p -79.3 161.82 26.02 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.949 -0.389 . . . . 0.8 109.949 178.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -59.27 -36.95 76.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.788 0.327 . . . . 2.13 110.483 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.3 -47.13 80.66 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.408 -0.36 . . . . 0.7 110.175 179.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -63.25 -40.95 98.85 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.119 0.485 . . . . 0.81 110.282 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.509 ' HG ' HG22 ' A' ' 29' ' ' THR . 55.3 tp -59.03 -43.6 91.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.444 -0.798 . . . . 0.76 111.072 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.508 ' O ' HG22 ' A' ' 52' ' ' ILE . 19.1 tt0 -75.74 -35.06 60.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.044 -0.525 . . . . 1.12 111.665 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -68.04 -25.42 65.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.925 0.393 . . . . 1.42 110.844 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.509 ' O ' HG12 ' A' ' 55' ' ' VAL . 1.9 mmm -64.37 -44.96 89.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.364 -0.38 . . . . 0.54 110.068 179.498 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.517 ' HA ' ' CG1' ' A' ' 55' ' ' VAL . 6.9 tp -70.92 -21.35 22.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.077 0.465 . . . . 0.59 109.976 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -78.21 -17.73 56.36 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.994 -0.743 . . . . 1.06 108.994 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.521 ' HG3' ' H ' ' B' ' 288' ' ' ALA . 19.3 tp10 -95.81 -0.67 50.91 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.418 -0.81 . . . . 1.58 111.239 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.713 HG21 ' CE2' ' B' ' 292' ' ' TRP . 1.0 OUTLIER -122.22 -46.27 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 N-CA-C 112.177 0.436 . . . . 0.82 112.177 -179.756 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.638 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 13.6 t70 -76.52 99.75 5.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.41 0.624 . . . . 0.7 111.288 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.71 -22.62 46.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.182 -0.917 . . . . 0.9 111.425 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -76.56 -0.78 24.44 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.194 -0.457 . . . . 0.85 111.967 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.97 46.37 84.45 Favored Glycine 0 C--O 1.224 -0.487 0 C-N-CA 121.554 -0.355 . . . . 1.03 113.977 178.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -127.46 -17.66 4.6 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.419 0.628 . . . . 1.61 109.697 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 76.64 24.08 68.43 Favored Glycine 0 N--CA 1.452 -0.238 0 CA-C-N 115.537 -0.756 . . . . 0.67 112.921 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.0 m -151.75 146.71 25.94 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.938 0.399 . . . . 0.65 110.552 179.106 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.479 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 0.9 OUTLIER -123.93 109.07 22.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.283 0.564 . . . . 0.5 110.023 179.12 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -78.81 -176.65 5.07 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.296 -0.866 . . . . 1.09 110.062 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.493 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 74.8 m-85 -57.72 -53.63 63.66 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 116.262 -0.426 . . . . 1.78 111.309 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 10.5 Cg_endo -56.23 -35.72 95.87 Favored 'Trans proline' 0 C--N 1.357 0.976 0 C-N-CA 122.497 2.131 . . . . 0.79 112.138 178.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.624 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 36.9 mt-10 -69.45 -39.21 77.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.164 -0.471 . . . . 0.66 110.047 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -59.66 -39.22 83.71 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.57 -0.741 . . . . 0.77 111.239 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 94.4 mt -64.29 -36.6 84.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.249 0.547 . . . . 0.9 110.599 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.6 m -80.41 -39.6 28.03 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.702 -0.681 . . . . 1.02 111.333 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 7.3 tpt -62.69 -54.45 39.21 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.85 -0.614 . . . . 0.69 112.056 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -4.61 30.24 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.708 0.632 . . . . 0.99 112.708 -177.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -101.48 2.9 39.74 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.995 0.426 . . . . 1.21 110.287 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.442 HH11 ' HD3' ' A' ' 74' ' ' ARG . 0.1 OUTLIER -124.88 78.3 1.68 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.038 -0.528 . . . . 2.56 111.051 -179.209 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.402 ' H ' ' HG2' ' A' ' 75' ' ' LYS . 16.5 pttm -86.21 169.65 12.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.841 0.353 . . . . 3.25 110.649 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 33.3 mtp -92.59 157.08 16.7 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.91 -0.586 . . . . 2.59 111.346 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -101.75 14.3 32.35 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.21 0.529 . . . . 2.45 111.386 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -92.42 171.39 9.07 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.124 -0.489 . . . . 2.35 110.346 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -74.32 122.68 23.28 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 110.081 -0.34 . . . . 3.14 110.081 179.3 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.143 0 CA-C-O 119.224 -0.417 . . . . 3.21 110.861 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 287' ' ' ARG . . . . . 0.421 ' HB3' ' OD1' ' B' ' 290' ' ' ASN . 4.4 ttm180 . . . . . 0 N--CA 1.477 0.91 0 N-CA-C 109.858 -0.423 . . . . 3.11 109.858 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.579 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -67.26 -20.44 65.66 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 112.568 0.581 . . . . 0.6 112.568 -178.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 289' ' ' ALA . . . . . 0.573 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -72.06 -3.49 23.31 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-O 121.356 0.598 . . . . 0.65 112.111 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 290' ' ' ASN . . . . . 0.421 ' OD1' ' HB3' ' B' ' 287' ' ' ARG . 3.2 m120 -111.86 -33.76 6.21 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 122.578 1.18 . . . . 0.87 109.893 175.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 291' ' ' LEU . . . . . 0.415 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 8.1 mp -79.74 -13.11 59.68 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 114.267 -1.333 . . . . 1.37 110.283 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.713 ' CE2' HG21 ' A' ' 55' ' ' VAL . 3.4 m0 -86.88 -54.65 0.38 Allowed Pre-proline 0 CA--C 1.531 0.222 0 N-CA-C 107.385 -1.339 . . . . 0.42 107.385 175.457 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.573 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 18.3 Cg_exo -49.23 -33.21 27.45 Favored 'Trans proline' 0 C--N 1.366 1.465 0 C-N-CA 122.631 2.221 . . . . 0.54 112.812 174.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.586 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 13.7 t -58.22 -63.43 3.96 Favored Pre-proline 0 CA--C 1.547 0.837 0 CA-C-O 118.999 -0.524 . . . . 0.95 110.847 179.427 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.586 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 76.1 Cg_exo -52.22 -35.82 64.86 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 122.243 1.962 . . . . 0.54 112.236 176.359 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 18.7 tp -69.09 -31.42 70.13 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.054 0.454 . . . . 0.56 109.782 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 297' ' ' MET . . . . . 0.404 ' O ' ' HB2' ' B' ' 300' ' ' ARG . 15.5 ttt -71.73 -42.55 67.15 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.175 -1.046 . . . . 1.79 108.175 178.034 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 42.0 mm -62.74 -33.14 58.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 107.94 -1.133 . . . . 0.5 107.94 176.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 299' ' ' LYS . . . . . 0.454 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.1 OUTLIER -64.31 -36.92 85.69 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 108.66 -0.867 . . . . 0.51 108.66 177.664 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 300' ' ' ARG . . . . . 0.404 ' HB2' ' O ' ' B' ' 297' ' ' MET . 44.5 mtt180 -66.7 -36.24 82.02 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.742 -0.836 . . . . 2.44 108.742 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 12.8 m -66.9 -38.33 86.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.973 -1.012 . . . . 0.66 109.275 178.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.45 -35.41 65.75 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.105 -0.702 . . . . 2.44 109.105 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -66.72 -36.06 81.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.399 0.619 . . . . 0.82 109.439 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -72.17 -39.92 68.32 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.197 -0.91 . . . . 1.16 109.145 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 8.4 m . . . . . 0 C--O 1.252 1.2 0 CA-C-O 118.239 -0.886 . . . . 1.39 110.149 179.356 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 181' ' ' ' CA' . . . . . 0.663 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 182' ' ' ' CA' . . . . . 0.638 'CA ' ' OD1' ' A' ' 56' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 . . . . . 0 N--CA 1.452 -0.359 0 N-CA-C 111.551 0.204 . . . . 1.18 111.551 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -74.49 -40.93 61.53 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.08 -0.711 . . . . 1.27 109.08 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -68.43 -22.36 64.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.455 -0.793 . . . . 0.99 110.331 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.4 ' CG ' ' HE3' ' B' ' 299' ' ' LYS . 5.1 tp10 -69.62 -27.12 64.81 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.653 -0.703 . . . . 1.29 110.478 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.32 -47.6 85.19 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.673 -0.491 . . . . 0.58 109.673 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -73.89 3.46 6.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.069 0.462 . . . . 0.98 111.61 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.4 m -112.76 -35.0 5.62 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.258 -0.428 . . . . 0.73 111.886 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.433 HD12 ' HG2' ' B' ' 299' ' ' LYS . 79.4 mt -105.13 -26.44 12.09 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.144 0.424 . . . . 0.55 112.144 -178.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -83.0 -49.06 9.97 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 121.043 -0.263 . . . . 0.79 111.318 -178.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -92.24 140.02 30.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.955 0.407 . . . . 0.59 111.166 -179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -125.43 3.44 7.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.0 -0.545 . . . . 1.57 110.5 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -90.17 -28.6 18.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.161 0.505 . . . . 0.82 109.976 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.89 27.7 9.34 Favored Glycine 0 N--CA 1.444 -0.784 0 N-CA-C 111.118 -0.793 . . . . 0.87 111.118 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -100.48 -31.54 11.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.305 -0.448 . . . . 0.74 111.126 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 69.45 36.99 78.58 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.867 -0.683 . . . . 1.3 112.085 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.4 HG22 ' HA ' ' A' ' 64' ' ' ASP . 5.3 p -139.4 152.96 47.52 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.823 -0.436 . . . . 0.66 109.823 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.444 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 74.5 mt -101.86 111.52 31.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-O 120.975 0.417 . . . . 0.5 110.936 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.7 p -118.71 -178.93 3.66 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.913 -0.773 . . . . 0.77 108.913 178.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.27 -30.45 60.13 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.288 -0.414 . . . . 0.59 111.739 178.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -64.71 -46.43 82.35 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.949 -0.568 . . . . 0.56 112.313 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 50.4 mp0 -81.88 -25.87 34.66 Favored 'General case' 0 C--N 1.332 -0.165 0 O-C-N 121.903 -0.498 . . . . 0.87 111.095 -177.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.5 tp -71.51 -33.55 69.32 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.531 -0.758 . . . . 0.47 110.755 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -91.41 -29.22 12.62 Favored Glycine 0 C--O 1.229 -0.187 0 C-N-CA 120.651 -0.785 . . . . 0.36 113.908 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -60.67 -40.73 93.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 117.354 0.577 . . . . 0.47 112.483 -178.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.411 HG11 ' HB3' ' B' ' 295' ' ' PRO . 7.3 p -67.5 -48.21 77.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 121.047 -0.261 . . . . 1.38 110.661 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 43.6 mtt -61.24 -36.63 80.49 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.784 0.326 . . . . 0.85 110.432 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 -56.58 -33.29 66.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.243 -0.89 . . . . 1.95 111.639 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 m -112.38 24.79 12.15 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.178 0.513 . . . . 0.59 111.019 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 22.7 tp -125.6 -49.02 1.65 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.031 -0.531 . . . . 0.72 111.124 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -155.5 43.7 0.55 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 121.015 -0.612 . . . . 0.56 112.214 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 71.67 143.32 0.06 Allowed 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.368 0.667 . . . . 2.83 111.165 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -88.05 133.0 38.12 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.703 -0.68 . . . . 0.96 110.822 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -74.54 -177.34 3.28 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.719 2.28 . . . . 0.61 111.307 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.3 p -78.39 165.15 24.15 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.877 -0.329 . . . . 0.8 110.719 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -57.52 -40.88 79.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.895 0.378 . . . . 2.13 110.957 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.07 -45.53 92.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.7 110.809 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -63.41 -36.55 84.12 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.443 -0.799 . . . . 0.81 111.059 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.7 tp -72.36 -38.29 68.6 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.266 -0.425 . . . . 0.76 110.174 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -59.89 -46.2 90.11 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.594 -0.73 . . . . 1.12 110.316 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -64.52 -37.1 86.37 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.498 -0.774 . . . . 1.42 110.792 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.491 ' O ' HG12 ' A' ' 55' ' ' VAL . 4.1 mmm -63.42 -46.41 86.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.905 -0.588 . . . . 0.54 112.504 -178.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 8.4 tp -72.1 -25.97 24.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 120.536 -0.466 . . . . 0.59 110.153 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -75.13 -21.74 58.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.65 0.738 . . . . 1.06 109.667 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.591 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 24.0 tt0 -84.08 -7.09 59.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.855 -1.066 . . . . 1.58 111.058 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.748 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -118.29 -48.95 3.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.451 -0.341 . . . . 0.82 111.234 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -75.01 101.43 4.48 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.781 0.324 . . . . 0.7 110.296 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -7.86 56.09 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.044 -0.526 . . . . 0.9 111.535 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.02 -27.85 39.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.989 0.423 . . . . 0.85 111.094 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 92.99 44.8 3.75 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.681 -0.771 . . . . 1.03 114.705 177.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -144.61 -11.97 0.59 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.282 0.541 . . . . 1.61 111.138 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 75.49 26.08 66.44 Favored Glycine 0 C--N 1.33 0.239 0 C-N-CA 120.701 -0.761 . . . . 0.67 112.582 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 93.8 m -138.89 134.83 33.77 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.097 0.475 . . . . 0.65 110.97 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.519 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 0.4 OUTLIER -119.38 119.31 60.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.553 -0.748 . . . . 0.5 110.313 178.59 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.4 ' HA ' HG22 ' A' ' 26' ' ' THR . 3.6 t70 -95.08 -173.17 2.88 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.646 -0.706 . . . . 1.09 110.043 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.519 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 15.1 m-85 -56.6 -52.97 69.4 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.368 -0.378 . . . . 1.78 111.498 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.7 Cg_endo -54.21 -37.2 87.79 Favored 'Trans proline' 0 C--N 1.364 1.365 0 C-N-CA 122.622 2.215 . . . . 0.79 112.258 178.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.425 ' HB2' HG23 ' A' ' 63' ' ' ILE . 29.1 mt-10 -72.95 -46.01 54.83 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.193 0.52 . . . . 0.66 110.481 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -59.29 -37.46 77.74 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.3 -0.864 . . . . 0.77 111.041 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 62.9 mt -59.65 -30.02 68.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.993 -0.549 . . . . 0.9 111.808 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.82 -37.6 10.67 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.194 0.521 . . . . 1.02 110.987 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.56 ' HE1' ' HA ' ' B' ' 289' ' ' ALA . 14.4 tpt -59.96 -48.94 79.63 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.596 -0.729 . . . . 0.69 112.102 -179.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.87 26.09 1.63 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.88 0.326 . . . . 0.99 111.88 -178.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -132.02 -36.85 1.16 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.998 0.428 . . . . 1.21 111.342 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.234 0.259 0 CA-C-O 120.766 0.317 . . . . 2.56 111.733 -178.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . 0.591 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 110.28 -0.267 . . . . 3.11 110.28 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.531 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . . . -59.93 -31.32 69.74 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-O 120.715 0.293 . . . . 0.6 110.753 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . 0.56 ' HA ' ' HE1' ' A' ' 71' ' ' MET . . . -68.57 -14.08 62.77 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 120.844 -0.342 . . . . 0.65 111.435 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . 0.496 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 3.5 m120 -102.68 -38.97 7.25 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.01 0.909 . . . . 0.87 109.292 175.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 1.1 mp -73.57 -10.28 59.55 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.944 -0.571 . . . . 1.37 111.155 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.748 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 2.6 m0 -87.15 -52.66 0.41 Allowed Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 107.766 -1.198 . . . . 0.42 107.766 175.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.516 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 12.8 Cg_exo -51.55 -33.82 49.66 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 123.454 2.77 . . . . 0.54 112.903 174.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.585 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 14.4 t -58.1 -60.11 11.13 Favored Pre-proline 0 CA--C 1.547 0.845 0 CA-C-O 119.203 -0.427 . . . . 0.95 110.903 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.585 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 78.8 Cg_exo -55.61 -34.37 89.94 Favored 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 122.025 1.816 . . . . 0.54 111.887 176.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 9.4 tp -65.35 -33.66 76.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.187 0.517 . . . . 0.56 109.745 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 2.7 ttt -67.84 -32.99 73.9 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.472 -0.936 . . . . 1.79 108.472 177.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 48.5 mm -69.99 -37.2 71.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.343 -0.984 . . . . 0.5 108.343 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . 0.564 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.1 OUTLIER -63.45 -42.23 98.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.169 -0.923 . . . . 0.51 109.264 178.092 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -40.34 94.38 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.258 -0.645 . . . . 2.44 109.258 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 53.7 m -64.54 -39.25 93.41 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.712 -0.676 . . . . 0.66 110.022 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -69.69 -34.61 74.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.086 -0.506 . . . . 2.44 109.89 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -66.44 -28.46 68.62 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.711 0.767 . . . . 0.82 109.503 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -85.5 -36.65 20.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.965 -1.016 . . . . 1.16 109.984 178.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 11.7 m . . . . . 0 C--O 1.255 1.35 0 CA-C-O 118.845 -0.598 . . . . 1.39 110.039 179.083 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 . . . . . 0 C--O 1.234 0.239 0 CA-C-O 120.417 0.151 . . . . 1.18 111.398 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -71.23 -42.68 68.57 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 120.993 0.425 . . . . 1.27 111.537 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 80.1 mttt -68.73 -19.81 64.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.084 -0.507 . . . . 0.99 110.049 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.44 ' HG3' ' CD1' ' A' ' 18' ' ' LEU . 2.2 tp10 -69.61 -30.79 68.61 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.455 -0.793 . . . . 1.29 110.295 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.512 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -61.04 -46.0 92.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.297 -0.411 . . . . 0.58 110.113 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -84.52 29.29 0.6 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.107 0.48 . . . . 0.98 110.779 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.7 m -137.06 -38.17 0.63 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.947 -0.569 . . . . 0.73 110.712 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.457 HD12 ' HG2' ' B' ' 299' ' ' LYS . 23.3 mt -109.46 -37.91 5.6 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 111.998 0.37 . . . . 0.55 111.998 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.512 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 78.1 t80 -67.26 -43.45 81.83 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.817 0.341 . . . . 0.79 110.396 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -92.29 144.62 25.21 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.002 -0.74 . . . . 0.59 109.002 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -119.37 -2.58 10.58 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.784 -0.367 . . . . 1.57 111.761 -178.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -93.23 -42.0 9.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.034 0.445 . . . . 0.82 110.547 -178.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 119.48 0.49 13.98 Favored Glycine 0 N--CA 1.442 -0.964 0 CA-C-N 115.456 -0.793 . . . . 0.87 111.651 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -75.61 -46.61 30.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.79 0.329 . . . . 0.74 111.155 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.99 26.22 41.96 Favored Glycine 0 CA--C 1.518 0.267 0 CA-C-N 116.264 -0.425 . . . . 1.3 112.295 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.9 152.05 31.34 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 110.4 -0.222 . . . . 0.66 110.4 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.564 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 10.7 mt -94.53 105.83 17.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.395 0.617 . . . . 0.5 110.802 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.86 165.84 17.33 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 114.786 -1.097 . . . . 0.77 109.215 178.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.82 -33.94 51.53 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.239 0.459 . . . . 0.59 112.239 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -61.85 -46.08 91.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.083 -0.508 . . . . 0.56 112.043 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.7 mp0 -77.12 -25.01 51.65 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.886 0.374 . . . . 0.87 110.95 -178.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.472 HD21 ' HE2' ' A' ' 51' ' ' MET . 18.3 tp -76.23 -47.25 24.63 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 116.031 -0.532 . . . . 0.47 110.271 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.99 -36.83 86.96 Favored Glycine 0 C--N 1.333 0.371 0 CA-C-N 115.637 -0.711 . . . . 0.36 114.091 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 p -59.94 -31.49 69.91 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 117.285 0.543 . . . . 0.47 112.406 -178.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.8 t -72.93 -53.42 18.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.811 -0.44 . . . . 1.38 109.811 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 23.9 mtt -58.73 -41.22 85.89 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.734 -0.666 . . . . 0.85 111.457 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.454 ' HG3' ' HB2' ' A' ' 42' ' ' ASN . 1.1 ttt180 -59.49 -43.06 93.42 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.373 -0.376 . . . . 1.95 111.059 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 69.0 m -85.33 -3.69 58.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.978 0.418 . . . . 0.59 111.848 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.0 tp -100.93 -62.13 1.28 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.806 0.336 . . . . 0.72 111.295 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -149.08 62.97 0.41 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.528 -0.844 . . . . 0.56 112.726 -178.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 69.5 158.64 0.17 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.579 0.704 . . . . 2.83 112.043 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.454 ' HB2' ' HG3' ' A' ' 37' ' ' ARG . 3.9 t30 -105.94 135.01 19.48 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.838 -0.619 . . . . 0.96 110.57 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -75.95 -168.04 0.51 Allowed 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.344 2.029 . . . . 0.61 111.45 178.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.5 p -80.39 165.92 21.77 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 110.311 -0.255 . . . . 0.8 110.311 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -65.19 -32.72 74.54 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.556 -0.535 . . . . 2.13 109.556 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.5 -50.09 71.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.726 -0.67 . . . . 0.7 110.15 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -64.92 -33.94 77.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.774 -0.648 . . . . 0.81 110.606 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 47.8 tp -62.81 -38.35 90.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.467 -0.788 . . . . 0.76 110.358 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.564 ' O ' HG22 ' A' ' 52' ' ' ILE . 6.6 tt0 -77.74 -42.07 35.53 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.885 -0.598 . . . . 1.12 110.123 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -59.51 -29.41 67.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.189 0.518 . . . . 1.42 110.455 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.472 ' HE2' HD21 ' A' ' 32' ' ' LEU . 1.7 mmm -69.21 -35.38 76.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.916 -0.584 . . . . 0.54 110.853 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 49' ' ' GLN . 5.0 tp -80.85 -13.09 12.8 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-O 121.467 0.651 . . . . 0.59 109.546 179.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -81.16 -27.18 35.54 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.497 -0.774 . . . . 1.06 109.32 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.609 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 22.3 tt0 -94.41 36.37 1.16 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.584 -0.734 . . . . 1.58 110.274 178.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.809 ' HB ' ' HB3' ' B' ' 288' ' ' ALA . 7.1 p -164.59 -32.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 C-N-CA 119.965 -0.694 . . . . 0.82 112.592 -177.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -93.09 80.13 4.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.99 0.424 . . . . 0.7 110.303 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.72 -28.46 61.05 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.55 -0.75 . . . . 0.9 112.791 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -69.48 -14.48 62.9 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.881 0.372 . . . . 0.85 110.828 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.55 51.48 58.47 Favored Glycine 0 C--N 1.333 0.373 0 CA-C-N 116.277 -0.42 . . . . 1.03 113.044 178.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -124.29 -25.7 4.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.17 0.51 . . . . 1.61 110.376 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.2 14.59 47.83 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.799 -0.637 . . . . 0.67 111.891 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.5 m -152.42 139.06 18.75 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 120.995 0.426 . . . . 0.65 111.379 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.647 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.4 OUTLIER -116.13 118.52 59.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 108.737 -0.838 . . . . 0.5 108.737 178.347 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -91.81 -172.39 3.18 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.645 -0.502 . . . . 1.09 109.645 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.491 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 31.0 m-85 -55.88 -53.92 57.8 Favored Pre-proline 0 CA--C 1.532 0.263 0 O-C-N 123.085 0.24 . . . . 1.78 111.17 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.7 Cg_endo -50.93 -43.18 48.86 Favored 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 122.236 1.957 . . . . 0.79 112.02 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.425 ' OE1' ' HA ' ' A' ' 63' ' ' ILE . 20.2 mt-10 -69.69 -43.22 72.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.362 -0.381 . . . . 0.66 110.759 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -56.77 -40.98 76.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.833 -0.621 . . . . 0.77 111.335 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.29 -34.75 77.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.686 -0.688 . . . . 0.9 110.7 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.7 m -81.79 -41.82 20.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.132 -0.485 . . . . 1.02 111.137 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.473 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 5.6 tpt -61.92 -50.09 73.58 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.516 0.562 . . . . 0.69 112.516 -178.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.67 -15.1 61.71 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.12 -0.632 . . . . 0.99 112.367 -178.162 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -96.69 -13.16 22.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.141 0.496 . . . . 1.21 110.262 178.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.331 -0.227 0 CA-C-N 115.741 -0.663 . . . . 2.56 110.307 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . 0.609 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 5.2 ttm180 . . . . . 0 N--CA 1.477 0.899 0 CA-C-O 120.718 0.294 . . . . 3.11 110.556 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.809 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -63.21 -31.61 72.8 Favored 'General case' 0 C--O 1.216 -0.709 0 N-CA-C 112.621 0.6 . . . . 0.6 112.621 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . 0.529 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -63.64 -3.52 2.31 Favored 'General case' 0 C--O 1.216 -0.658 0 N-CA-C 113.335 0.865 . . . . 0.65 113.335 -179.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -111.42 -35.97 5.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 122.286 1.041 . . . . 0.87 109.973 177.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . 0.4 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 8.2 mp -80.22 -8.36 59.41 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 114.077 -1.419 . . . . 1.37 109.979 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.69 ' CE2' HG21 ' A' ' 55' ' ' VAL . 6.5 m0 -90.72 -54.56 0.28 Allowed Pre-proline 0 CA--C 1.535 0.394 0 N-CA-C 107.176 -1.416 . . . . 0.42 107.176 175.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.539 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 21.4 Cg_exo -50.77 -32.81 38.16 Favored 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 122.751 2.301 . . . . 0.54 112.571 174.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.572 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 19.5 t -59.78 -61.76 7.24 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-O 119.124 -0.465 . . . . 0.95 110.688 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.572 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 93.1 Cg_exo -52.06 -36.23 64.77 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 121.594 1.529 . . . . 0.54 112.215 176.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 14.2 tp -65.21 -32.68 74.48 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.347 0.594 . . . . 0.56 109.735 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 17.7 ttt -73.31 -45.36 55.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.208 -0.906 . . . . 1.79 108.926 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 46.2 mm -61.1 -33.65 56.92 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 N-CA-C 108.881 -0.785 . . . . 0.5 108.881 178.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . 0.567 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.2 OUTLIER -62.95 -43.85 97.65 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.18 -0.918 . . . . 0.51 109.105 178.21 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -41.62 89.7 Favored 'General case' 0 C--N 1.333 -0.113 0 N-CA-C 108.945 -0.761 . . . . 2.44 108.945 178.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 67.9 m -65.01 -42.86 94.06 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.619 -0.719 . . . . 0.66 110.676 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 22.5 tptp -67.49 -36.24 80.72 Favored 'General case' 0 C--O 1.225 -0.219 0 N-CA-C 110.014 -0.365 . . . . 2.44 110.014 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 3.2 tttp -63.48 -30.45 71.57 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.942 -0.762 . . . . 0.82 108.942 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -82.07 -31.59 30.74 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.099 -0.955 . . . . 1.16 109.907 178.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.8 m . . . . . 0 C--O 1.247 0.926 0 CA-C-N 115.453 -0.794 . . . . 1.39 111.216 179.827 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.236 0.373 0 CA-C-O 121.016 0.436 . . . . 1.18 110.063 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -69.25 -32.72 72.13 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.439 0.637 . . . . 1.27 109.317 178.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -70.34 -20.23 63.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.294 -0.866 . . . . 0.99 111.202 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.561 ' HG3' HD12 ' A' ' 18' ' ' LEU . 3.7 tp10 -66.94 -24.61 66.1 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 109.181 -0.674 . . . . 1.29 109.181 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 19' ' ' PHE . . . -69.28 -37.42 77.85 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.743 -0.466 . . . . 0.58 109.743 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -86.59 14.98 6.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.883 0.373 . . . . 0.98 110.754 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.3 m -129.03 -35.45 1.84 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.952 0.406 . . . . 0.73 110.914 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.561 HD12 ' HG3' ' A' ' 14' ' ' GLU . 44.6 mt -99.37 -28.55 13.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.277 -0.419 . . . . 0.55 111.938 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.447 ' HB2' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -80.93 -57.6 3.47 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.225 0.536 . . . . 0.79 110.005 -179.012 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -82.4 142.0 32.32 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.004 -0.998 . . . . 0.59 111.146 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -128.89 6.8 5.53 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.104 -0.702 . . . . 1.57 109.104 178.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -95.08 -25.72 16.34 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.849 -0.614 . . . . 0.82 111.643 -178.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.05 22.14 23.64 Favored Glycine 0 N--CA 1.442 -0.914 0 N-CA-C 110.709 -0.956 . . . . 0.87 110.709 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -95.8 -32.8 12.52 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.641 -0.503 . . . . 0.74 109.641 179.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.16 28.74 73.82 Favored Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.863 -0.684 . . . . 1.3 112.878 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.5 p -132.35 128.16 37.06 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 122.932 -0.158 . . . . 0.66 111.227 -179.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.474 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 47.9 mt -75.14 112.19 12.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 120.97 0.414 . . . . 0.5 111.379 -179.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.5 p -117.8 177.87 4.61 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.417 -0.811 . . . . 0.77 108.815 178.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.457 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -58.02 -28.24 64.27 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.779 0.323 . . . . 0.59 111.143 178.207 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 44.6 tttt -65.88 -44.63 84.78 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 112.175 0.435 . . . . 0.56 112.175 -179.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.3 mp0 -78.98 -22.03 46.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.95 0.405 . . . . 0.87 111.143 -178.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.4 tp -83.46 -38.66 21.55 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.096 -0.502 . . . . 0.47 110.748 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.18 -32.75 51.45 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.736 -0.745 . . . . 0.36 113.619 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -60.41 -44.91 95.25 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.272 0.471 . . . . 0.47 112.272 -178.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.5 p -66.5 -48.33 80.9 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 120.978 -0.289 . . . . 1.38 110.734 -178.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 56.6 mtt -56.56 -46.38 80.75 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.718 0.294 . . . . 0.85 111.538 178.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -58.39 -29.5 66.09 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.172 -0.467 . . . . 1.95 111.313 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.0 m -99.05 3.88 46.92 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.13 -0.486 . . . . 0.59 111.337 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.5 tp -113.97 -34.14 5.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.314 -0.403 . . . . 0.72 111.408 -178.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -169.3 53.23 0.21 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.225 -0.988 . . . . 0.56 112.829 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 72.89 175.9 0.27 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.495 0.664 . . . . 2.83 111.894 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -116.76 123.72 30.07 Favored Pre-proline 0 C--N 1.318 -0.791 0 CA-C-N 115.273 -0.876 . . . . 0.96 109.56 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -77.48 -163.92 0.24 Allowed 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.162 1.908 . . . . 0.61 111.106 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.6 p -82.55 158.97 22.91 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.01 -0.676 . . . . 0.8 110.195 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.3 mp0 -57.15 -35.28 69.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.97 -0.559 . . . . 2.13 110.533 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.3 -46.14 91.54 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.425 0.631 . . . . 0.7 110.165 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -64.96 -41.11 95.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.216 -0.902 . . . . 0.81 110.37 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.457 ' HG ' HG22 ' A' ' 29' ' ' THR . 18.9 tp -65.05 -43.08 93.48 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.738 -0.664 . . . . 0.76 110.216 179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.476 ' O ' HG22 ' A' ' 52' ' ' ILE . 14.7 tt0 -66.59 -46.76 74.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.288 -0.415 . . . . 1.12 110.66 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -56.18 -35.5 67.31 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.044 0.45 . . . . 1.42 110.741 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.466 ' O ' HG12 ' A' ' 55' ' ' VAL . 2.9 mmm -66.72 -45.96 77.01 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.504 -0.771 . . . . 0.54 111.265 -179.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.476 HG22 ' O ' ' A' ' 49' ' ' GLN . 8.9 tp -69.5 -22.99 25.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-O 121.096 0.474 . . . . 0.59 110.251 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.54 -24.97 41.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.675 0.75 . . . . 1.06 109.193 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.497 ' HB3' ' HB2' ' B' ' 288' ' ' ALA . 9.1 tp10 -77.41 -9.54 58.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.01 -0.995 . . . . 1.58 110.372 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.704 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 0.7 OUTLIER -118.9 -49.72 3.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.292 -0.413 . . . . 0.82 111.849 -179.699 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -79.4 103.8 9.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 0.7 110.841 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.32 -25.69 46.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.867 -0.606 . . . . 0.9 112.598 -178.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -64.14 -39.25 93.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.683 -0.235 . . . . 0.85 111.419 -179.031 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 101.99 31.21 5.46 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.38 -0.914 . . . . 1.03 113.332 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -127.86 -6.04 5.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.84 0.352 . . . . 1.61 110.807 179.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.48 34.69 88.51 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.663 -0.779 . . . . 0.67 112.252 179.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.7 m -142.74 131.69 22.96 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 110.014 -0.365 . . . . 0.65 110.014 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.546 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.1 OUTLIER -113.35 121.71 66.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.141 0.496 . . . . 0.5 111.16 179.662 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -92.43 -176.96 4.47 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.488 -0.778 . . . . 1.09 110.747 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.509 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 36.1 m-85 -52.92 -54.9 38.7 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 116.467 -0.333 . . . . 1.78 111.788 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.8 Cg_endo -59.13 -32.57 97.47 Favored 'Trans proline' 0 C--N 1.36 1.152 0 C-N-CA 122.121 1.881 . . . . 0.79 113.674 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -70.39 -42.88 71.12 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.252 0.549 . . . . 0.66 110.296 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -66.68 -44.34 82.01 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.584 -0.734 . . . . 0.77 110.73 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 81.4 mt -59.73 -29.62 68.26 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.427 -0.352 . . . . 0.9 111.409 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.7 m -81.92 -44.6 16.58 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.097 0.406 . . . . 1.02 112.097 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.639 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 24.5 ttt -67.27 -49.73 63.22 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.676 0.621 . . . . 0.69 112.676 -178.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.453 ' HE1' ' HB3' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -74.34 3.45 7.35 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.892 0.701 . . . . 0.99 112.892 -178.122 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -115.44 -11.08 11.88 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.257 0.551 . . . . 1.21 109.997 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.509 0 CA-C-N 115.473 -0.785 . . . . 2.56 110.173 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . 0.43 ' HB3' ' OD1' ' B' ' 290' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 109.488 -0.56 . . . . 3.11 109.488 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.497 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . . . -72.25 -24.8 61.42 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-O 121.232 0.539 . . . . 0.6 110.975 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . 0.639 ' HA ' ' CE ' ' A' ' 71' ' ' MET . . . -68.53 -0.55 5.21 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.219 0.822 . . . . 0.65 113.219 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . 0.511 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 2.9 m120 -114.38 -36.47 4.63 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 123.233 1.492 . . . . 0.87 109.745 176.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 6.4 mt -80.82 -3.06 49.76 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 113.018 -1.901 . . . . 1.37 111.156 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.704 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 3.1 m0 -100.04 -52.7 0.18 Allowed Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 107.449 -1.315 . . . . 0.42 107.449 174.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.59 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 11.6 Cg_exo -49.54 -39.05 45.75 Favored 'Trans proline' 0 C--N 1.376 1.978 0 C-N-CA 122.969 2.446 . . . . 0.54 111.545 175.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.461 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 3.1 t -60.83 -64.05 3.58 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 108.617 -0.883 . . . . 0.95 108.617 177.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.461 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 2.8 Cg_exo -47.3 -36.17 22.16 Favored 'Trans proline' 0 C--N 1.359 1.11 0 C-N-CA 122.599 2.2 . . . . 0.54 112.834 174.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 13.0 tp -70.85 -37.49 73.14 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 120.725 0.298 . . . . 0.56 110.528 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 14.6 ttt -65.08 -36.25 83.74 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.522 -0.918 . . . . 1.79 108.522 178.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 30.9 mm -66.07 -37.52 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-N 114.776 -1.102 . . . . 0.5 108.434 176.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . 0.528 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.2 OUTLIER -65.08 -40.99 95.44 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 108.684 -0.858 . . . . 0.51 108.684 177.355 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 16.9 mtp180 -61.91 -38.69 89.33 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.04 -0.726 . . . . 2.44 109.04 178.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 67.2 m -64.03 -45.21 89.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.562 -0.745 . . . . 0.66 110.339 178.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 15.6 tptp -68.56 -30.6 69.41 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.101 0.476 . . . . 2.44 109.863 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 6.1 tttp -68.2 -31.23 70.61 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.896 0.855 . . . . 0.82 108.796 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -77.41 -40.05 44.92 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.66 -1.155 . . . . 1.16 108.932 177.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 C--O 1.247 0.963 0 CA-C-N 115.61 -0.723 . . . . 1.39 111.025 178.836 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 . . . . . 0 C--O 1.237 0.434 0 CA-C-O 120.85 0.357 . . . . 1.18 110.734 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -72.38 -36.62 68.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.841 -0.618 . . . . 1.27 109.79 178.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -67.89 -26.4 65.98 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.824 -0.626 . . . . 0.99 110.227 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.508 ' HG2' ' HE3' ' B' ' 299' ' ' LYS . 4.9 tp10 -60.78 -33.63 73.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.54 -0.754 . . . . 1.29 109.939 178.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.01 -41.5 99.57 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.921 -0.581 . . . . 0.58 109.741 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -77.1 3.03 13.44 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.214 -0.448 . . . . 0.98 111.56 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 7.5 m -117.54 -36.98 3.56 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.194 -0.457 . . . . 0.73 111.486 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.457 HD12 ' HG2' ' B' ' 299' ' ' LYS . 89.1 mt -96.3 -20.09 18.78 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.102 0.408 . . . . 0.55 112.102 -179.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -85.86 -53.62 5.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.9 0.381 . . . . 0.79 110.216 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -83.06 142.58 31.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.481 -0.781 . . . . 0.59 111.631 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.8 mptt -127.77 -10.06 5.54 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.999 -0.546 . . . . 1.57 110.622 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.81 -41.46 30.2 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 120.983 0.421 . . . . 0.82 110.198 -178.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 115.94 1.62 20.81 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 111.187 -0.765 . . . . 0.87 111.187 -178.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -72.47 -36.09 68.38 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.885 -0.413 . . . . 0.74 109.885 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.54 35.78 62.74 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.871 -0.68 . . . . 1.3 112.467 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.76 145.7 38.59 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 110.273 -0.269 . . . . 0.66 110.273 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 65.1 mt -87.91 111.29 21.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 C-N-CA 120.661 -0.416 . . . . 0.5 110.793 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.3 p -123.65 -177.5 3.75 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.777 -0.823 . . . . 0.77 108.777 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.612 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -57.75 -30.94 66.0 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.474 0.546 . . . . 0.59 112.474 179.015 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -64.32 -48.23 76.41 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.03 0.752 . . . . 0.56 113.03 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.407 ' HA ' ' OG1' ' A' ' 34' ' ' THR . 51.1 mp0 -79.31 -22.52 44.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.449 0.642 . . . . 0.87 110.954 -177.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 35.8 tp -74.33 -35.97 63.64 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.2 -0.909 . . . . 0.47 110.742 -179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -88.26 -29.17 20.55 Favored Glycine 0 CA--C 1.518 0.246 0 C-N-CA 120.786 -0.721 . . . . 0.36 113.099 -179.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.407 ' OG1' ' HA ' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -60.78 -40.97 94.56 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.944 0.372 . . . . 0.47 111.541 -178.663 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.431 HG13 ' N ' ' A' ' 36' ' ' MET . 14.5 p -68.96 -48.29 71.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.523 -0.308 . . . . 1.38 110.403 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.431 ' N ' HG13 ' A' ' 35' ' ' VAL . 61.6 mtt -60.22 -42.27 94.81 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.675 -0.239 . . . . 0.85 111.267 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -35.07 74.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.306 -0.406 . . . . 1.95 110.769 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.7 m -91.09 0.35 57.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.259 -0.428 . . . . 0.59 111.367 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.3 tp -103.92 -57.89 1.96 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.782 0.325 . . . . 0.72 110.983 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -151.19 45.67 0.63 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.675 -0.774 . . . . 0.56 111.899 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 71.21 155.96 0.15 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.423 0.689 . . . . 2.83 110.984 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -106.6 138.0 19.63 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.25 -0.432 . . . . 0.96 110.853 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.38 -164.45 0.16 Allowed 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 122.572 2.181 . . . . 0.61 111.421 178.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.1 p -75.86 163.51 27.15 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.835 -0.346 . . . . 0.8 110.363 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -62.96 -30.45 71.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.045 -0.525 . . . . 2.13 110.963 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.87 -42.61 99.83 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.151 0.5 . . . . 0.7 110.667 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -71.56 -36.28 70.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.776 -0.647 . . . . 0.81 110.107 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.612 ' HG ' HG22 ' A' ' 29' ' ' THR . 59.6 tp -64.14 -45.76 87.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.619 -0.718 . . . . 0.76 110.381 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -69.11 -32.13 71.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.952 0.405 . . . . 1.12 110.829 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -69.71 -38.98 77.13 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.302 -0.408 . . . . 1.42 110.155 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.448 ' O ' HG12 ' A' ' 55' ' ' VAL . 4.9 mmm -57.5 -46.35 83.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.72 -0.673 . . . . 0.54 112.125 -179.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.404 ' HA ' ' CG1' ' A' ' 55' ' ' VAL . 8.8 tp -69.16 -22.44 26.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 120.603 -0.439 . . . . 0.59 111.263 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -22.83 51.83 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.212 0.53 . . . . 1.06 109.6 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.603 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 7.3 tt0 -82.36 -18.73 41.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.678 -0.692 . . . . 1.58 110.665 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.784 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -103.72 -48.33 10.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.153 0.427 . . . . 0.82 112.153 -179.71 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -83.35 106.01 14.77 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.274 0.559 . . . . 0.7 110.932 -179.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.2 -20.4 28.6 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.503 -0.771 . . . . 0.9 112.057 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.34 -29.43 69.62 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 110.037 -0.357 . . . . 0.85 110.037 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 91.41 34.15 7.63 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.77 -0.729 . . . . 1.03 114.11 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -129.65 -5.96 4.64 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 122.512 -0.405 . . . . 1.61 110.187 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.11 13.57 64.73 Favored Glycine 0 C--N 1.336 0.57 0 C-N-CA 121.282 -0.485 . . . . 0.67 112.954 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 3.9 m -119.04 130.07 55.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.751 0.31 . . . . 0.65 110.51 -179.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.631 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.4 OUTLIER -121.21 120.0 60.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.962 -0.563 . . . . 0.5 110.685 178.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -99.2 -172.91 2.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.164 -0.925 . . . . 1.09 109.955 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.528 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 4.3 m-85 -54.07 -54.97 41.39 Favored Pre-proline 0 N--CA 1.466 0.366 0 C-N-CA 122.549 0.339 . . . . 1.78 111.593 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.8 Cg_endo -52.13 -42.13 61.06 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 122.684 2.256 . . . . 0.79 112.775 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -69.0 -48.08 63.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.66 110.373 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -58.58 -47.42 84.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.511 -0.768 . . . . 0.77 111.75 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 70.2 mt -59.3 -26.75 65.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.209 -0.45 . . . . 0.9 111.811 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.5 m -93.55 -36.42 12.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.523 -0.308 . . . . 1.02 110.995 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.427 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 6.5 tpt -62.63 -47.94 81.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.69 111.47 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.26 2.88 6.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.102 -0.499 . . . . 0.99 111.3 -179.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -119.8 11.88 11.99 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.212 0.53 . . . . 1.21 110.364 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.2 mmm180 . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.8 -0.636 . . . . 2.56 110.858 -179.833 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . 0.603 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 1.5 ttm180 . . . . . 0 N--CA 1.479 1.005 0 N-CA-C 109.833 -0.432 . . . . 3.11 109.833 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . . . . . . . . . . . -57.95 -30.57 66.08 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 113.148 0.796 . . . . 0.6 113.148 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . 0.699 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -67.67 -15.27 63.56 Favored 'General case' 0 C--O 1.201 -1.478 0 CA-C-O 118.728 -0.653 . . . . 0.65 109.838 -178.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -98.45 -40.34 8.32 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 118.477 0.58 . . . . 0.87 110.884 174.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 9.0 mp -75.2 -9.91 58.98 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 115.545 -0.752 . . . . 1.37 111.263 -179.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.784 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 2.2 m95 -88.92 -54.59 0.32 Allowed Pre-proline 0 C--N 1.321 -0.638 0 N-CA-C 107.601 -1.259 . . . . 0.42 107.601 175.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.699 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 6.6 Cg_exo -48.02 -36.76 28.6 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 123.653 2.902 . . . . 0.54 113.141 174.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.529 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 12.5 t -59.39 -62.03 6.67 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 119.126 -0.464 . . . . 0.95 111.332 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.529 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 92.7 Cg_exo -51.33 -35.87 55.48 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 122.016 1.811 . . . . 0.54 112.178 176.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 46.3 tp -66.95 -38.44 86.12 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.719 -0.474 . . . . 0.56 109.719 178.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 27.5 ttt -63.53 -37.07 85.91 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.52 -0.919 . . . . 1.79 108.52 177.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 44.0 mm -64.33 -38.99 83.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 108.379 -0.971 . . . . 0.5 108.379 177.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . 0.508 ' HE3' ' HG2' ' A' ' 14' ' ' GLU . 0.1 OUTLIER -62.16 -44.17 97.21 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.866 -0.606 . . . . 0.51 109.474 178.087 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -62.83 -38.2 89.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.743 -0.662 . . . . 2.44 109.769 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 22.7 m -67.75 -33.89 75.74 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.929 -0.578 . . . . 0.66 109.833 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -77.27 -29.68 54.01 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.14 -0.689 . . . . 2.44 109.14 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . 0.498 ' HG3' ' HG2' ' A' ' 14' ' ' GLU . 0.9 OUTLIER -70.51 -33.73 71.53 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 108.404 -0.962 . . . . 0.82 108.404 178.893 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -77.62 -40.54 41.61 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.34 -0.985 . . . . 1.16 108.34 177.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 3.5 m . . . . . 0 C--O 1.251 1.172 0 CA-C-N 115.768 -0.651 . . . . 1.39 111.221 177.858 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 C--O 1.234 0.251 0 CA-C-O 121.538 0.685 . . . . 1.18 109.781 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -76.36 -35.06 58.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.319 -0.855 . . . . 1.27 109.758 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.604 ' HA ' ' CD2' ' A' ' 16' ' ' PHE . 81.6 mttt -66.21 -28.85 69.06 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.498 0.666 . . . . 0.99 109.427 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.402 ' HB3' ' HZ2' ' B' ' 299' ' ' LYS . 3.8 tp10 -60.0 -36.81 78.0 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.775 -1.102 . . . . 1.29 110.851 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.471 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -64.49 -39.19 93.33 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.939 -0.573 . . . . 0.58 111.011 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.604 ' CD2' ' HA ' ' A' ' 13' ' ' LYS . 9.7 m-85 -65.75 -14.0 60.46 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.704 0.288 . . . . 0.98 111.444 -179.282 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 42.5 m -110.71 -36.03 5.83 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.382 0.512 . . . . 0.73 112.382 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.0 mt -91.93 -22.93 19.77 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.337 0.495 . . . . 0.55 112.337 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.471 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 84.8 t80 -91.55 -50.01 6.0 Favored 'General case' 0 C--N 1.327 -0.38 0 O-C-N 122.353 -0.217 . . . . 0.79 110.622 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -80.46 148.52 30.45 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.384 -0.371 . . . . 0.59 111.099 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -130.61 15.04 5.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.32 -0.4 . . . . 1.57 111.361 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -108.94 -38.34 5.61 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.063 0.459 . . . . 0.82 110.525 -178.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 122.64 -13.15 8.75 Favored Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 111.109 -0.797 . . . . 0.87 111.109 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -69.1 -39.52 78.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.424 -0.388 . . . . 0.74 110.986 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 75.18 24.96 69.88 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.873 -0.68 . . . . 1.3 112.903 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.703 HG22 ' HA ' ' A' ' 64' ' ' ASP . 22.5 p -119.7 156.26 30.83 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.935 0.368 . . . . 0.66 110.727 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.594 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 55.7 mt -96.14 108.35 21.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.027 0.441 . . . . 0.5 111.36 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.68 175.9 6.0 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.425 -0.807 . . . . 0.77 109.592 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.474 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -53.43 -41.81 66.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.234 0.54 . . . . 0.59 111.892 179.916 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -58.03 -53.3 59.76 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.343 -0.844 . . . . 0.56 113.269 -178.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 18.4 mp0 -75.73 -23.49 56.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.679 0.276 . . . . 0.87 111.716 -177.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.427 HD11 ' CD1' ' B' ' 292' ' ' TRP . 14.4 tp -69.93 -49.98 46.6 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.05 -0.523 . . . . 0.47 109.966 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.585 ' O ' ' HB2' ' A' ' 37' ' ' ARG . . . -71.68 -36.91 61.83 Favored Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 115.47 -0.786 . . . . 0.36 113.634 -178.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.62 -41.23 89.94 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 117.825 0.813 . . . . 0.47 112.232 -178.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.405 HG11 ' HB3' ' B' ' 295' ' ' PRO . 72.7 t -71.93 -57.02 8.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.666 0.27 . . . . 1.38 110.918 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 36.3 mtt -58.43 -27.56 64.44 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.396 -0.365 . . . . 0.85 111.517 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.585 ' HB2' ' O ' ' A' ' 33' ' ' GLY . 43.6 ttt180 -62.97 -32.69 74.07 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.986 -0.552 . . . . 1.95 111.158 178.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.5 m -94.3 -3.98 49.54 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.955 -0.566 . . . . 0.59 111.373 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.4 tp -95.33 -42.35 8.56 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.251 -0.431 . . . . 0.72 110.858 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 41' ' ' GLN . . . -163.31 38.35 0.33 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.699 -0.763 . . . . 0.56 112.163 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 40' ' ' GLY . 1.2 mp0 71.79 154.01 0.13 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.449 0.642 . . . . 2.83 111.644 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -119.28 139.24 27.32 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.034 -0.53 . . . . 0.96 110.117 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -77.12 -157.76 0.07 OUTLIER 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.312 2.008 . . . . 0.61 113.045 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.0 p -77.73 160.85 28.15 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 122.045 -0.409 . . . . 0.8 111.911 -178.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -54.71 -31.53 58.28 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.744 -0.662 . . . . 2.13 110.865 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.4 -54.22 40.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 0.7 110.597 179.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -64.19 -34.02 77.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.746 -0.661 . . . . 0.81 110.515 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.474 ' HG ' HG22 ' A' ' 29' ' ' THR . 46.6 tp -67.71 -41.61 83.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.671 -0.695 . . . . 0.76 110.747 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.498 ' O ' HG22 ' A' ' 52' ' ' ILE . 23.0 tt0 -67.35 -32.23 73.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.169 -0.469 . . . . 1.12 110.144 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -66.87 -32.36 73.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.203 0.525 . . . . 1.42 109.922 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.4 mmm -64.61 -38.78 92.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.425 -0.807 . . . . 0.54 111.276 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.498 HG22 ' O ' ' A' ' 49' ' ' GLN . 6.9 tp -75.89 -12.64 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.152 0.501 . . . . 0.59 110.914 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -85.44 -21.75 28.6 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.932 -0.766 . . . . 1.06 108.932 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.674 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 11.4 tt0 -89.76 16.8 7.37 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.384 -1.28 . . . . 1.58 110.572 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.712 ' HB ' ' HB3' ' B' ' 288' ' ' ALA . 6.6 p -146.82 -38.6 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 120.094 -0.642 . . . . 0.82 112.557 -177.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -85.79 98.49 10.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.319 0.58 . . . . 0.7 109.716 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.4 -19.77 29.21 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 113.018 0.747 . . . . 0.9 113.018 -177.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -71.4 -36.62 71.44 Favored 'General case' 0 C--N 1.327 -0.39 0 O-C-N 122.444 -0.16 . . . . 0.85 110.821 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 101.25 49.0 1.37 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.204 -0.998 . . . . 1.03 113.839 178.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 27.0 p-10 -135.31 -14.53 1.98 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 117.111 0.456 . . . . 1.61 110.531 178.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 72.69 24.84 75.41 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 121.087 -0.577 . . . . 0.67 112.63 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 18.4 m -155.35 126.72 7.26 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.78 -0.452 . . . . 0.65 109.78 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.485 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.6 OUTLIER -100.47 108.85 23.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 120.456 -0.498 . . . . 0.5 110.479 179.829 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.703 ' HA ' HG22 ' A' ' 26' ' ' THR . 28.5 t0 -83.17 175.04 10.26 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.097 -0.956 . . . . 1.09 110.052 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.448 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 4.5 m-85 -46.17 -53.69 21.25 Favored Pre-proline 0 CA--C 1.544 0.725 0 N-CA-C 112.915 0.709 . . . . 1.78 112.915 -178.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.448 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 19.7 Cg_endo -59.14 -38.56 85.84 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 122.138 1.892 . . . . 0.79 112.866 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -66.53 -40.38 89.1 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.187 0.518 . . . . 0.66 110.257 -179.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -63.38 -36.33 83.35 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.45 -0.795 . . . . 0.77 110.903 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.5 mt -62.34 -23.37 66.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.181 -0.463 . . . . 0.9 111.693 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.11 -40.42 9.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.192 0.52 . . . . 1.02 110.508 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.573 ' HE3' ' HA ' ' B' ' 289' ' ' ALA . 10.9 tpt -54.84 -48.83 72.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.264 -0.88 . . . . 0.69 111.803 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.429 ' SD ' ' HG3' ' A' ' 71' ' ' MET . 0.1 OUTLIER -89.8 22.93 2.9 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 122.241 -0.287 . . . . 0.99 111.77 -179.442 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.09 -41.81 1.11 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.298 0.571 . . . . 1.21 111.454 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? . . . . . 0 C--N 1.321 -0.665 0 CA-C-N 116.016 -0.538 . . . . 2.56 110.829 -179.47 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . 0.674 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 1.4 tpm_? . . . . . 0 N--CA 1.479 0.978 0 N-CA-C 110.564 -0.162 . . . . 3.11 110.564 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.712 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -58.44 -30.91 67.28 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 120.801 0.334 . . . . 0.6 111.39 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . 0.717 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -70.44 -12.21 61.42 Favored 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 116.05 -0.523 . . . . 0.65 111.316 -178.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . 0.448 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 14.8 m120 -99.87 -40.86 7.48 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-O 121.76 0.791 . . . . 0.87 110.033 173.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . 0.585 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 5.7 mt -66.38 -44.54 82.85 Favored 'General case' 0 C--O 1.206 -1.211 0 CA-C-N 114.77 -1.105 . . . . 1.37 109.42 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.681 ' CE2' HG21 ' A' ' 55' ' ' VAL . 10.3 m0 -56.29 -53.92 58.56 Favored Pre-proline 0 N--CA 1.467 0.411 0 N-CA-C 109.519 -0.549 . . . . 0.42 109.519 177.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.717 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 13.1 Cg_exo -47.79 -31.56 15.24 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 122.673 2.248 . . . . 0.54 112.951 175.205 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.571 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 6.0 m -58.05 -65.0 2.11 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-O 118.459 -0.781 . . . . 0.95 110.847 178.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.585 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 86.9 Cg_exo -52.56 -33.75 59.65 Favored 'Trans proline' 0 C--N 1.369 1.65 0 C-N-CA 121.62 1.547 . . . . 0.54 112.884 176.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 10.7 tp -67.09 -38.79 86.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.234 0.54 . . . . 0.56 109.609 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 24.8 ttt -67.47 -38.93 85.15 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.715 -0.846 . . . . 1.79 108.715 178.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . 0.482 HG12 ' O ' ' B' ' 294' ' ' SER . 18.3 mm -66.91 -36.2 76.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.021 -0.991 . . . . 0.5 108.689 177.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . 0.402 ' HZ2' ' HB3' ' A' ' 14' ' ' GLU . 0.1 OUTLIER -63.75 -35.75 81.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.698 -0.683 . . . . 0.51 109.419 178.199 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 2.4 mmt180 -68.12 -38.4 82.18 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.855 -0.611 . . . . 2.44 109.583 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 28.6 m -69.62 -33.74 73.09 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.54 -0.754 . . . . 0.66 110.401 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -77.11 -32.83 56.83 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.292 -0.632 . . . . 2.44 109.292 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.5 -33.2 74.61 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.705 -0.68 . . . . 0.82 109.202 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -77.88 -35.96 50.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.254 -0.885 . . . . 1.16 109.941 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.5 t . . . . . 0 C--O 1.252 1.201 0 CA-C-O 118.108 -0.949 . . . . 1.39 110.301 179.662 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 . . . . . 0 N--CA 1.453 -0.298 0 CA-C-O 120.908 0.385 . . . . 1.18 110.315 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.1 m-30 -70.93 -37.27 72.88 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.068 -0.514 . . . . 1.27 110.45 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -64.71 -32.99 74.92 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 121.61 0.719 . . . . 0.99 110.046 179.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.487 ' HA ' ' OE1' ' A' ' 14' ' ' GLU . 1.4 tp10 -59.64 -32.28 70.29 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.459 -0.791 . . . . 1.29 110.639 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.31 -45.76 86.53 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.147 -0.479 . . . . 0.58 110.738 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -82.1 12.23 4.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.799 0.333 . . . . 0.98 111.808 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.8 m -123.05 -44.27 2.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.365 -0.38 . . . . 0.73 111.019 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.48 ' HB2' ' CG ' ' B' ' 299' ' ' LYS . 92.4 mt -88.98 -31.85 17.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.826 0.346 . . . . 0.55 111.456 -179.329 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -77.54 -56.34 4.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.882 0.372 . . . . 0.79 110.43 -179.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -86.02 140.17 30.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.812 -0.631 . . . . 0.59 110.751 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.3 mptt -119.22 -0.17 11.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.923 -0.581 . . . . 1.57 111.305 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -86.95 -45.07 11.14 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.087 0.47 . . . . 0.82 110.031 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 119.26 -6.66 12.9 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 110.586 -1.006 . . . . 0.87 110.586 -178.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -61.52 -33.52 73.96 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 114.642 -0.779 . . . . 0.74 109.966 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.66 41.97 97.49 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.008 -0.615 . . . . 1.3 112.77 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -141.9 145.85 35.07 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.811 -0.194 . . . . 0.66 110.517 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.491 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 89.9 mt -84.68 106.47 14.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.076 0.465 . . . . 0.5 110.355 178.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.09 178.11 4.75 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.869 -0.605 . . . . 0.77 109.651 179.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.52 -35.22 67.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.01 0.433 . . . . 0.59 111.086 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -58.91 -49.08 79.15 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.943 -0.571 . . . . 0.56 112.168 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 54.8 mp0 -81.01 -26.01 36.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.257 0.551 . . . . 0.87 111.335 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.459 HD21 ' CE ' ' A' ' 51' ' ' MET . 20.1 tp -72.35 -32.85 66.83 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.387 -0.824 . . . . 0.47 110.213 -179.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -86.74 -33.37 13.06 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.87 -0.681 . . . . 0.36 113.825 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.88 -40.03 79.28 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 112.41 0.522 . . . . 0.47 112.41 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.5 p -70.51 -50.71 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 O-C-N 122.17 -0.331 . . . . 1.38 110.636 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.0 mtt -56.26 -43.74 79.04 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.065 0.46 . . . . 0.85 111.264 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -53.99 -42.01 68.56 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.373 -0.83 . . . . 1.95 111.872 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.8 m -84.17 -18.72 35.74 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.071 -0.513 . . . . 0.59 111.77 -178.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.6 mp -87.85 -53.16 4.9 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 111.894 0.331 . . . . 0.72 111.894 -178.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -150.55 43.19 0.73 Allowed Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.471 -0.871 . . . . 0.56 112.154 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 71.32 155.45 0.15 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.604 0.716 . . . . 2.83 111.344 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -95.61 134.19 24.57 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.728 -0.669 . . . . 0.96 109.91 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.25 -160.46 0.11 Allowed 'Trans proline' 0 C--O 1.23 0.116 0 C-N-CA 122.824 2.35 . . . . 0.61 111.301 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.1 p -83.63 165.17 19.21 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 109.689 -0.486 . . . . 0.8 109.689 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -64.91 -24.13 67.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 2.13 110.199 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.24 -50.87 62.29 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.313 -0.403 . . . . 0.7 110.859 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -68.11 -33.72 75.05 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.317 0.58 . . . . 0.81 110.199 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.5 tp -68.3 -41.36 81.04 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.732 -0.667 . . . . 0.76 111.424 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.481 ' O ' HG22 ' A' ' 52' ' ' ILE . 23.4 tt0 -67.64 -40.78 84.56 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.876 -0.602 . . . . 1.12 110.792 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -72.6 -27.07 61.94 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.576 -0.45 . . . . 1.42 110.706 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.463 ' O ' HG12 ' A' ' 55' ' ' VAL . 1.1 tmm? -62.91 -38.58 91.53 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.494 -0.321 . . . . 0.54 110.48 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.481 HG22 ' O ' ' A' ' 49' ' ' GLN . 10.3 tp -78.76 -15.82 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 CA-C-O 121.368 0.604 . . . . 0.59 110.062 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -83.98 -27.88 28.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.827 0.822 . . . . 1.06 108.872 178.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.438 ' CD ' ' HG3' ' B' ' 287' ' ' ARG . 0.9 OUTLIER -81.54 14.79 2.36 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.977 -1.01 . . . . 1.58 111.0 -179.629 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.685 HG21 ' CE2' ' B' ' 292' ' ' TRP . 1.4 p -144.24 -41.16 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 116.477 -0.328 . . . . 0.82 111.253 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -77.94 92.19 4.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.653 0.739 . . . . 0.7 110.827 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.53 -29.29 68.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.082 -0.963 . . . . 0.9 112.283 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.96 -39.71 87.32 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 121.053 -0.259 . . . . 0.85 110.484 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 95.12 46.99 2.71 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.953 -0.642 . . . . 1.03 113.249 178.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -137.47 -0.76 2.15 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.432 0.634 . . . . 1.61 110.233 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.89 15.5 69.26 Favored Glycine 0 C--N 1.334 0.459 0 CA-C-N 115.57 -0.741 . . . . 0.67 113.191 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.8 m -134.05 133.82 41.63 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 121.377 0.608 . . . . 0.65 111.373 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.641 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.3 OUTLIER -121.19 118.6 56.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.966 -0.561 . . . . 0.5 109.763 178.974 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -99.06 -172.59 2.31 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 123.743 0.652 . . . . 1.09 109.749 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.484 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 0.4 OUTLIER -51.75 -55.32 31.01 Favored Pre-proline 0 N--CA 1.469 0.494 0 CA-C-O 119.088 -0.482 . . . . 1.78 112.121 -179.659 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 6.0 Cg_endo -49.07 -44.61 32.31 Favored 'Trans proline' 0 C--N 1.354 0.816 0 C-N-CA 122.456 2.104 . . . . 0.79 112.48 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -69.34 -47.16 65.2 Favored 'General case' 0 C--O 1.222 -0.348 0 O-C-N 123.881 0.738 . . . . 0.66 110.51 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -59.03 -40.48 85.16 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.049 0.452 . . . . 0.77 111.462 -178.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 97.7 mt -57.23 -35.06 69.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.629 -0.714 . . . . 0.9 111.272 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -87.24 -37.82 16.9 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.279 -0.419 . . . . 1.02 110.903 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.583 ' HE3' ' HA ' ' B' ' 289' ' ' ALA . 11.1 tpt -59.1 -46.97 86.95 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.905 -0.589 . . . . 0.69 111.639 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.69 29.43 1.16 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.666 -0.243 . . . . 0.99 111.267 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -136.46 -49.63 0.66 Allowed 'General case' 0 C--O 1.237 0.415 0 CA-C-O 120.842 0.353 . . . . 1.21 110.357 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.064 -0.516 . . . . 2.56 109.842 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . 0.438 ' HG3' ' CD ' ' A' ' 54' ' ' GLU . 8.4 ttt-85 . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 109.353 -0.61 . . . . 3.11 109.353 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.539 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -59.88 -23.77 63.72 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.049 0.452 . . . . 0.6 111.559 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . 0.693 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -67.43 -11.81 58.71 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-O 119.02 -0.514 . . . . 0.65 109.655 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -99.9 -35.32 9.79 Favored 'General case' 0 C--O 1.246 0.915 0 CA-C-O 121.473 0.654 . . . . 0.87 111.086 174.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . 0.495 ' O ' ' HG2' ' B' ' 295' ' ' PRO . 7.1 mp -79.73 -8.08 59.02 Favored 'General case' 0 C--O 1.213 -0.868 0 C-N-CA 123.878 0.871 . . . . 1.37 110.416 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.685 ' CE2' HG21 ' A' ' 55' ' ' VAL . 6.1 m0 -92.45 -55.1 0.25 Allowed Pre-proline 0 C--N 1.318 -0.792 0 N-CA-C 108.062 -1.088 . . . . 0.42 108.062 174.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.693 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 9.8 Cg_exo -48.51 -38.63 35.92 Favored 'Trans proline' 0 C--N 1.36 1.133 0 C-N-CA 123.337 2.691 . . . . 0.54 112.707 175.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.497 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 5.6 t -61.53 -62.58 5.62 Favored Pre-proline 0 CA--C 1.546 0.817 0 N-CA-C 108.616 -0.883 . . . . 0.95 108.616 178.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.497 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 1.0 OUTLIER -46.25 -40.18 21.67 Favored 'Trans proline' 0 C--N 1.361 1.192 0 C-N-CA 123.156 2.571 . . . . 0.54 113.343 174.745 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 13.5 tp -68.86 -37.39 79.07 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.049 0.452 . . . . 0.56 109.968 178.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 27.2 ttt -63.61 -37.6 87.95 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.614 -0.884 . . . . 1.79 108.614 178.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 34.3 mm -62.75 -41.21 91.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.113 -0.949 . . . . 0.5 109.073 177.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . 0.48 ' CG ' ' HB2' ' A' ' 18' ' ' LEU . 0.2 OUTLIER -62.45 -43.75 98.06 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.452 -0.795 . . . . 0.51 109.753 179.182 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -64.06 -33.98 76.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.295 0.569 . . . . 2.44 110.419 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 39.5 m -69.98 -34.72 73.73 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.621 -0.718 . . . . 0.66 109.245 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -75.98 -28.61 57.93 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 109.423 -0.584 . . . . 2.44 109.423 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -69.97 -35.42 74.45 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.691 -0.855 . . . . 0.82 108.691 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -76.14 -40.02 53.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.189 -0.914 . . . . 1.16 109.104 178.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 6.9 m . . . . . 0 C--O 1.247 0.935 0 CA-C-N 114.848 -1.069 . . . . 1.39 111.763 178.692 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 . . . . . 0 C--O 1.235 0.318 0 CA-C-O 120.972 0.415 . . . . 1.18 110.518 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 18.6 m-30 -75.94 -40.31 54.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.698 -0.683 . . . . 1.27 109.3 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -64.79 -26.48 68.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.211 -0.904 . . . . 0.99 109.969 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.433 ' HG2' ' HE3' ' B' ' 299' ' ' LYS . 1.8 tp10 -67.37 -23.85 65.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.456 -0.793 . . . . 1.29 110.171 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.654 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -74.35 -37.54 63.49 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 109.793 -0.447 . . . . 0.58 109.793 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -75.26 -2.02 26.14 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.557 -0.457 . . . . 0.98 110.512 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -112.6 -53.56 2.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.965 0.412 . . . . 0.73 111.474 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.445 HD12 ' HG2' ' B' ' 299' ' ' LYS . 74.1 mt -85.76 -42.34 14.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.243 -0.435 . . . . 0.55 111.7 -179.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.654 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 82.6 t80 -75.06 -35.31 61.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.304 -0.407 . . . . 0.79 111.259 -177.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -91.96 130.58 37.68 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.844 -0.428 . . . . 0.59 109.844 179.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.472 ' HZ1' HG23 ' A' ' 35' ' ' VAL . 6.1 mptt -106.14 -9.65 16.84 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.439 0.533 . . . . 1.57 112.439 -178.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.67 -35.56 14.13 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 111.688 0.255 . . . . 0.82 111.688 -178.076 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.06 0.76 33.75 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 121.184 -0.531 . . . . 0.87 111.815 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -81.33 -27.98 34.73 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.812 0.339 . . . . 0.74 110.576 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.06 -46.07 3.59 Favored Glycine 0 CA--C 1.518 0.249 0 C-N-CA 121.318 -0.468 . . . . 1.3 113.475 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -53.27 123.72 12.65 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.522 0.564 . . . . 0.66 112.522 -179.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.575 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 18.0 mt -69.83 119.28 15.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-N 116.254 -0.43 . . . . 0.5 111.32 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.26 168.66 14.44 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 108.9 -0.778 . . . . 0.77 108.9 178.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.78 -33.78 64.68 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.817 0.341 . . . . 0.59 111.709 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -60.47 -45.44 93.72 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.353 0.501 . . . . 0.56 112.353 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.4 mp0 -80.37 -23.21 40.62 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-O 121.216 0.531 . . . . 0.87 111.688 -178.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.0 tp -72.06 -50.74 25.86 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.851 -0.613 . . . . 0.47 110.167 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.09 -36.13 79.8 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.787 -0.642 . . . . 0.36 113.939 -179.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -55.7 -32.71 63.54 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 117.677 0.738 . . . . 0.47 112.385 -178.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.472 HG23 ' HZ1' ' A' ' 21' ' ' LYS . 99.0 t -77.53 -51.61 17.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.233 -0.587 . . . . 1.38 109.955 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 52.6 mtt -59.0 -32.81 70.02 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.924 -0.58 . . . . 0.85 111.841 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.1 ttt180 -58.43 -40.45 82.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.45 -0.341 . . . . 1.95 111.789 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.1 m -97.29 -6.65 33.92 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.112 0.482 . . . . 0.59 110.645 -178.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 16.2 tp -87.06 -47.74 8.67 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.911 -0.586 . . . . 0.72 110.167 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -161.48 47.47 0.37 Allowed Glycine 0 C--N 1.335 0.479 0 C-N-CA 120.45 -0.881 . . . . 0.56 112.634 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 69.98 140.23 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.508 0.671 . . . . 2.83 111.476 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -99.36 136.51 20.4 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.029 -0.532 . . . . 0.96 110.587 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.61 -163.74 0.22 Allowed 'Trans proline' 0 C--O 1.24 0.575 0 C-N-CA 122.898 2.398 . . . . 0.61 112.063 179.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 73.0 p -73.64 163.9 27.38 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.355 -0.609 . . . . 0.8 109.355 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -68.18 -29.13 67.92 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.914 0.387 . . . . 2.13 110.181 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.37 -49.76 72.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.946 -0.57 . . . . 0.7 110.422 178.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -63.54 -35.42 80.44 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.909 -0.587 . . . . 0.81 110.644 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.0 tp -70.07 -34.55 73.33 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.949 -0.569 . . . . 0.76 110.182 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.506 ' O ' HG22 ' A' ' 52' ' ' ILE . 15.8 tt0 -68.11 -39.91 82.67 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.545 -0.539 . . . . 1.12 109.545 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -61.02 -29.84 69.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.557 0.694 . . . . 1.42 109.722 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.0 mmm -65.43 -43.27 90.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.353 -0.84 . . . . 0.54 111.946 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.506 HG22 ' O ' ' A' ' 49' ' ' GLN . 4.8 tp -71.73 -18.33 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 CA-C-O 120.985 0.422 . . . . 0.59 111.355 -178.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -81.06 -25.02 37.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.625 0.726 . . . . 1.06 110.577 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.413 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 13.1 tt0 -93.51 8.26 41.35 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.325 -0.852 . . . . 1.58 111.046 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.795 ' HB ' ' HB3' ' B' ' 288' ' ' ALA . 8.5 p -142.85 25.86 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.806 0.812 . . . . 0.82 112.701 -177.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -146.65 95.53 2.61 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.683 0.754 . . . . 0.7 109.709 178.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.24 -29.98 70.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.334 -0.848 . . . . 0.9 112.047 -178.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.48 -16.02 62.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.998 0.428 . . . . 0.85 111.068 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.77 41.73 95.56 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 121.147 -0.549 . . . . 1.03 113.669 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -120.7 -19.96 7.21 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.955 0.407 . . . . 1.61 110.587 179.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 86.12 27.89 29.76 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 115.89 -0.595 . . . . 0.67 112.578 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.3 m -154.78 142.88 20.24 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 121.365 0.602 . . . . 0.65 110.963 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.518 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 1.4 mt -123.35 113.71 38.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.696 -0.684 . . . . 0.5 109.787 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -87.06 -171.0 3.3 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.455 -0.793 . . . . 1.09 110.285 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.504 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 3.9 m-85 -58.48 -53.4 66.53 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 116.004 -0.544 . . . . 1.78 111.536 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.504 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.6 Cg_endo -55.17 -38.69 93.44 Favored 'Trans proline' 0 C--N 1.361 1.214 0 C-N-CA 122.274 1.982 . . . . 0.79 112.85 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.518 ' HB2' HG23 ' A' ' 63' ' ' ILE . 38.2 mt-10 -68.38 -44.94 74.05 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.222 0.534 . . . . 0.66 111.154 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -58.2 -29.77 65.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.235 -0.893 . . . . 0.77 112.135 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 80.4 mt -61.82 -27.3 68.67 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-N 116.41 -0.359 . . . . 0.9 111.427 179.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -106.62 -26.92 11.15 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.894 -0.322 . . . . 1.02 111.215 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.615 ' HG3' ' SD ' ' A' ' 72' ' ' MET . 10.5 tpt -49.82 -52.02 35.42 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.298 0.481 . . . . 0.69 112.298 -179.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.615 ' SD ' ' HG3' ' A' ' 71' ' ' MET . 0.3 OUTLIER -94.04 17.65 12.04 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.274 0.472 . . . . 0.99 112.274 -178.83 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -110.39 -41.57 4.34 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.885 0.374 . . . . 1.21 111.21 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? . . . . . 0 C--N 1.325 -0.481 0 N-CA-C 109.917 -0.401 . . . . 2.56 109.917 -179.539 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . 0.435 HH11 ' HD2' ' B' ' 287' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 110.02 -0.363 . . . . 3.11 110.02 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.795 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -58.58 -24.15 60.23 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-O 120.99 0.424 . . . . 0.6 110.517 178.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . 0.57 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -68.97 -14.54 63.1 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 115.733 -0.667 . . . . 0.65 111.002 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . 0.4 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 6.5 m120 -96.14 -39.88 9.48 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 109.092 -0.707 . . . . 0.87 109.092 175.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . 0.78 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 1.2 mp -64.53 -42.54 95.69 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 115.212 -0.903 . . . . 1.37 109.385 178.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.575 ' CZ3' HD12 ' A' ' 27' ' ' ILE . 4.4 m0 -56.56 -57.28 24.49 Favored Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 108.307 -0.998 . . . . 0.42 108.307 177.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.57 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 7.0 Cg_exo -50.06 -24.71 11.41 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.844 2.362 . . . . 0.54 113.759 175.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.499 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 50.6 m -60.44 -68.39 0.79 Allowed Pre-proline 0 CA--C 1.544 0.715 0 CA-C-O 118.484 -0.769 . . . . 0.95 109.585 178.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.78 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 69.6 Cg_exo -48.88 -38.32 38.09 Favored 'Trans proline' 0 C--N 1.371 1.72 0 C-N-CA 121.88 1.72 . . . . 0.54 112.629 175.094 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . 0.516 ' O ' ' HG3' ' B' ' 300' ' ' ARG . 19.6 tp -61.39 -37.93 85.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.161 -0.472 . . . . 0.56 110.011 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 6.2 ttt -67.16 -39.69 86.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.818 -0.628 . . . . 1.79 109.46 178.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 43.6 mm -64.73 -39.63 86.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.646 0.736 . . . . 0.5 109.057 178.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . 0.523 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.1 OUTLIER -62.68 -40.84 98.36 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.905 -1.043 . . . . 0.51 109.119 178.011 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . 0.516 ' HG3' ' O ' ' B' ' 296' ' ' LEU . 30.3 mtp180 -63.29 -44.79 94.05 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.734 -0.666 . . . . 2.44 109.898 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 50.7 m -59.95 -37.83 80.69 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.71 -0.677 . . . . 0.66 110.109 178.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.2 tptp -73.25 -38.31 66.03 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 110.09 -0.337 . . . . 2.44 110.09 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -64.83 -28.48 69.58 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.603 0.716 . . . . 0.82 109.638 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -81.46 -30.99 33.2 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.142 -0.935 . . . . 1.16 109.636 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 13.0 m . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.304 -0.855 . . . . 1.39 112.294 179.112 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.233 0.209 0 CA-C-O 121.04 0.448 . . . . 1.18 110.475 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -76.51 -32.08 58.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.98 -0.555 . . . . 1.27 110.032 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -72.09 -15.45 62.01 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.171 0.51 . . . . 0.99 110.679 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.417 ' HG3' ' CD1' ' A' ' 18' ' ' LEU . 3.0 tp10 -72.45 -26.05 61.68 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.907 -0.588 . . . . 1.29 110.386 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.588 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -66.73 -43.09 85.12 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.163 -0.471 . . . . 0.58 110.78 -178.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -80.65 5.32 15.89 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.367 -0.379 . . . . 0.98 110.871 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.3 m -112.74 -41.28 3.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.73 112.075 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.634 HD12 ' HG2' ' B' ' 299' ' ' LYS . 18.2 mt -103.49 -44.15 5.2 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.438 0.532 . . . . 0.55 112.438 -178.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.588 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 83.1 t80 -62.59 -34.23 76.58 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.247 0.546 . . . . 0.79 110.435 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -93.95 138.63 31.86 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.688 -0.687 . . . . 0.59 110.139 178.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -124.52 32.62 5.43 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.257 -0.277 . . . . 1.57 110.989 -179.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -131.61 -31.14 1.59 Allowed 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.641 -0.424 . . . . 0.82 111.195 -179.207 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.73 18.65 17.6 Favored Glycine 0 CA--C 1.505 -0.562 0 N-CA-C 111.045 -0.822 . . . . 0.87 111.045 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -97.36 -32.17 12.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.294 -0.453 . . . . 0.74 110.596 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 69.13 31.6 72.2 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 120.922 -0.656 . . . . 1.3 113.707 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.82 138.07 53.29 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 117.909 0.854 . . . . 0.66 110.675 179.17 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 28.6 mt -81.8 111.46 18.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-O 121.089 0.471 . . . . 0.5 111.219 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -128.11 170.18 13.23 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.353 -0.84 . . . . 0.77 109.319 178.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.84 -31.74 59.8 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.18 0.514 . . . . 0.59 112.217 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.2 tttt -62.11 -45.53 93.06 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.273 0.559 . . . . 0.56 112.212 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.5 mp0 -79.22 -20.95 47.0 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.896 -0.593 . . . . 0.87 111.162 -178.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.414 HD21 ' CE ' ' A' ' 51' ' ' MET . 23.5 tp -80.0 -47.39 15.01 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.428 -0.806 . . . . 0.47 110.602 -179.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.14 -37.12 72.34 Favored Glycine 0 CA--C 1.512 -0.145 0 CA-C-N 115.429 -0.805 . . . . 0.36 113.289 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 p -57.12 -28.1 62.39 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.983 0.392 . . . . 0.47 111.89 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 93.5 t -77.07 -56.28 8.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 120.881 -0.328 . . . . 1.38 110.616 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 51.3 mtt -57.69 -37.72 73.95 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.447 -0.342 . . . . 0.85 110.872 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -55.12 -42.18 72.64 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.755 -0.657 . . . . 1.95 111.366 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.8 m -89.58 -19.48 24.92 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.842 0.354 . . . . 0.59 111.786 -178.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.3 tp -79.9 -36.87 35.82 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 112.14 0.422 . . . . 0.72 112.14 -179.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.13 43.81 0.14 Allowed Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.702 -0.761 . . . . 0.56 112.454 -178.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 70.85 147.49 0.07 Allowed 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.77 0.795 . . . . 2.83 111.936 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -102.64 134.8 19.69 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.644 -0.707 . . . . 0.96 109.819 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.7 -161.2 0.11 Allowed 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.475 2.117 . . . . 0.61 112.514 179.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.5 p -76.43 162.16 28.08 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.535 -0.302 . . . . 0.8 110.319 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.431 ' CD ' ' H ' ' A' ' 45' ' ' GLU . 2.9 mp0 -61.92 -31.03 71.31 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 116.676 -0.238 . . . . 2.13 111.199 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.72 -49.21 77.37 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.144 0.497 . . . . 0.7 110.312 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -66.52 -35.12 79.47 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.054 -0.521 . . . . 0.81 110.877 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 21.2 tp -71.61 -34.54 69.94 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.642 -0.708 . . . . 0.76 111.217 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.404 ' O ' HG22 ' A' ' 52' ' ' ILE . 21.4 tt0 -71.55 -39.28 70.78 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.697 -0.483 . . . . 1.12 109.697 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -60.04 -32.38 70.85 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.562 -0.745 . . . . 1.42 109.909 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.414 ' CE ' HD21 ' A' ' 32' ' ' LEU . 1.8 mmm -62.22 -45.98 90.94 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.196 -0.911 . . . . 0.54 110.66 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.638 ' HA ' HG12 ' A' ' 55' ' ' VAL . 6.1 tp -75.98 -18.49 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 C-N-CA 120.71 -0.396 . . . . 0.59 111.41 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -78.96 -20.09 50.05 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.298 0.571 . . . . 1.06 110.269 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.502 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 14.4 tt0 -99.08 9.5 43.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.564 -0.744 . . . . 1.58 111.706 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.769 ' HB ' ' CB ' ' B' ' 288' ' ' ALA . 9.5 p -137.6 -13.07 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-O 121.227 0.537 . . . . 0.82 112.34 -176.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -109.49 98.48 7.86 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.74 -0.837 . . . . 0.7 108.74 178.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.0 -22.18 61.46 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 115.957 -0.565 . . . . 0.9 111.936 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.42 -24.28 57.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.155 0.502 . . . . 0.85 110.529 178.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 75.8 29.04 59.87 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.926 -0.654 . . . . 1.03 113.219 178.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -108.05 -22.17 12.51 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.137 -0.69 . . . . 1.61 109.137 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.99 -2.71 64.14 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.846 -0.693 . . . . 0.67 113.526 178.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.3 m -128.13 153.51 46.78 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-O 121.289 0.566 . . . . 0.65 111.526 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.612 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.5 OUTLIER -132.57 122.76 48.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.628 -0.715 . . . . 0.5 110.317 179.515 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -96.11 -171.17 2.26 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 123.709 0.631 . . . . 1.09 110.503 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.516 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 4.8 m-85 -54.18 -55.09 40.39 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 123.801 0.84 . . . . 1.78 111.422 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 10.1 Cg_endo -53.33 -42.68 63.45 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 122.937 2.425 . . . . 0.79 111.845 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.444 ' OE2' HG12 ' A' ' 63' ' ' ILE . 23.5 mt-10 -65.47 -48.94 70.95 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.216 -0.902 . . . . 0.66 109.68 178.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -56.67 -43.93 80.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.316 0.579 . . . . 0.77 110.367 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.4 mt -55.56 -31.86 62.52 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.177 -0.92 . . . . 0.9 111.72 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.3 m -94.61 -38.28 10.93 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.921 0.391 . . . . 1.02 111.263 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.437 ' HE1' HG23 ' A' ' 55' ' ' VAL . 12.4 tpt -61.26 -59.24 5.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.992 -0.549 . . . . 0.69 111.937 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.405 ' SD ' ' HG3' ' A' ' 71' ' ' MET . 0.1 OUTLIER -77.93 31.98 0.17 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.4 -0.364 . . . . 0.99 111.437 -179.064 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.407 ' H ' ' C ' ' A' ' 71' ' ' MET . . . -136.69 -22.32 1.25 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.171 -0.468 . . . . 1.21 111.604 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? . . . . . 0 C--N 1.328 -0.368 0 CA-C-O 121.255 0.55 . . . . 2.56 111.437 -179.18 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . 0.502 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 120.906 0.384 . . . . 3.11 110.146 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.769 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -57.86 -25.01 60.14 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 116.12 -0.491 . . . . 0.6 112.3 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . 0.4 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -69.94 -1.72 10.42 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 113.24 0.83 . . . . 0.65 113.24 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . 0.472 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 7.3 m120 -112.11 -30.77 7.11 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.303 0.573 . . . . 0.87 109.477 176.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' B' ' 291' ' ' LEU . 33.0 mt -80.92 -6.02 58.17 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 114.879 -1.055 . . . . 1.37 109.809 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.612 ' CH2' HD12 ' A' ' 63' ' ' ILE . 1.7 m0 -92.13 -53.23 0.27 Allowed Pre-proline 0 CA--C 1.543 0.7 0 N-CA-C 107.589 -1.263 . . . . 0.42 107.589 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.472 ' HD2' ' C ' ' B' ' 290' ' ' ASN . 13.3 Cg_exo -51.68 -36.3 60.84 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 123.05 2.5 . . . . 0.54 112.921 175.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.493 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 2.7 t -58.98 -61.45 7.79 Favored Pre-proline 0 CA--C 1.548 0.885 0 CA-C-O 119.282 -0.389 . . . . 0.95 111.063 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.493 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 88.4 Cg_exo -53.12 -33.09 62.23 Favored 'Trans proline' 0 C--N 1.358 1.058 0 C-N-CA 122.691 2.261 . . . . 0.54 112.596 178.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 15.5 tp -68.02 -35.37 78.18 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.126 0.489 . . . . 0.56 110.091 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 16.7 ttt -70.34 -38.43 74.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.23 -0.896 . . . . 1.79 108.699 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . 0.407 HG12 ' O ' ' B' ' 294' ' ' SER . 48.9 mm -61.74 -38.37 80.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 108.211 -1.033 . . . . 0.5 108.211 177.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . 0.634 ' HG2' HD12 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -59.99 -39.97 87.56 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.308 -0.627 . . . . 0.51 109.308 177.451 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -64.89 -41.15 95.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.55 -0.75 . . . . 2.44 110.414 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 19.4 m -63.45 -35.88 81.91 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.738 -0.664 . . . . 0.66 109.595 178.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 14.3 tptp -76.28 -30.21 57.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.066 -0.515 . . . . 2.44 109.736 179.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 9.4 tttp -68.71 -34.58 75.88 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.806 -0.812 . . . . 0.82 108.806 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -76.01 -40.34 53.78 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.568 -1.196 . . . . 1.16 110.08 179.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.668 -0.682 . . . . 1.39 111.455 179.575 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 . . . . . 0 C--O 1.236 0.343 0 CA-C-O 120.866 0.365 . . . . 1.18 111.32 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -80.46 -37.54 31.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.145 0.498 . . . . 1.27 109.802 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -61.64 -22.69 65.49 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.507 0.67 . . . . 0.99 111.206 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.504 ' CG ' ' HE3' ' B' ' 299' ' ' LYS . 1.3 tp10 -70.88 -22.0 62.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.387 -0.824 . . . . 1.29 112.076 -177.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.697 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -70.18 -36.31 74.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.181 0.515 . . . . 0.58 110.647 179.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.422 ' HB3' ' HA3' ' A' ' 25' ' ' GLY . 10.5 m-85 -86.19 16.55 4.25 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.022 -0.535 . . . . 0.98 109.665 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.6 m -125.56 -56.58 1.49 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.886 -0.597 . . . . 0.73 112.202 -178.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.494 ' HB2' ' CG ' ' B' ' 299' ' ' LYS . 13.6 mt -96.1 -30.56 13.47 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.255 0.465 . . . . 0.55 112.255 -178.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.697 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 46.5 t80 -73.92 -34.03 64.2 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.062 0.458 . . . . 0.79 110.096 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -91.22 140.69 29.56 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.685 -0.689 . . . . 0.59 109.605 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -114.74 6.55 15.63 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.579 0.585 . . . . 1.57 112.579 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.62 -53.86 2.62 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.419 -0.512 . . . . 0.82 110.942 -178.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 139.44 4.38 1.46 Allowed Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.827 -0.701 . . . . 0.87 112.34 -178.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.93 -58.15 2.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.974 0.416 . . . . 0.74 110.017 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.422 ' HA3' ' HB3' ' A' ' 16' ' ' PHE . . . 111.84 -29.95 8.13 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.798 -0.637 . . . . 1.3 111.556 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.85 130.22 40.28 Favored 'General case' 0 C--N 1.323 -0.549 0 O-C-N 123.925 0.427 . . . . 0.66 111.859 -179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.579 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 24.1 mt -78.79 108.45 12.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 116.107 -0.497 . . . . 0.5 110.615 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.91 170.9 9.34 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 108.49 -0.93 . . . . 0.77 108.49 177.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.473 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -57.58 -31.69 66.42 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 111.679 0.252 . . . . 0.59 111.679 -179.54 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.9 tttt -63.8 -44.96 91.76 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.066 0.395 . . . . 0.56 112.066 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 25.2 mp0 -79.97 -21.81 43.31 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 111.742 0.275 . . . . 0.87 111.742 -178.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.593 HD21 ' HE2' ' A' ' 51' ' ' MET . 18.1 tp -79.53 -46.62 17.01 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.083 -0.508 . . . . 0.47 110.77 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.82 -36.32 86.74 Favored Glycine 0 N--CA 1.453 -0.212 0 CA-C-N 115.851 -0.613 . . . . 0.36 113.104 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.71 -31.05 67.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.771 0.286 . . . . 0.47 111.351 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 67.0 t -73.23 -56.55 9.18 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 N-CA-C 109.265 -0.643 . . . . 1.38 109.265 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 59.9 mtt -52.15 -46.9 65.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.121 -0.945 . . . . 0.85 111.134 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -57.28 -38.02 73.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.433 -0.803 . . . . 1.95 111.3 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.0 m -95.41 14.18 23.42 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.102 -0.499 . . . . 0.59 111.671 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.8 tp -122.03 -43.1 2.35 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.536 0.208 . . . . 0.72 110.916 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -164.24 49.93 0.29 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.618 -0.801 . . . . 0.56 112.599 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 72.35 146.07 0.08 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.517 0.727 . . . . 2.83 111.707 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -87.2 140.55 32.44 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.453 -0.794 . . . . 0.96 109.88 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -77.91 -172.96 1.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.271 1.981 . . . . 0.61 111.388 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.7 p -81.76 160.33 23.63 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.935 -0.765 . . . . 0.8 108.935 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -55.16 -32.92 62.52 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.059 0.392 . . . . 2.13 112.059 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.41 -52.34 58.68 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.224 -0.444 . . . . 0.7 110.829 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -64.01 -34.03 77.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.439 . . . . 0.81 110.839 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.473 ' HG ' HG22 ' A' ' 29' ' ' THR . 15.3 tp -63.73 -47.15 82.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.256 -0.429 . . . . 0.76 110.346 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -69.97 -33.39 72.02 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 116.353 -0.385 . . . . 1.12 111.459 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -71.78 -26.8 62.58 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.318 0.58 . . . . 1.42 110.157 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.593 ' HE2' HD21 ' A' ' 32' ' ' LEU . 1.8 mmm -61.95 -42.25 98.9 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.462 -0.79 . . . . 0.54 110.859 178.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.471 ' HA ' HG12 ' A' ' 55' ' ' VAL . 5.4 tp -76.87 -14.67 14.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-O 121.164 0.507 . . . . 0.59 110.278 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.5 t30 -78.37 -22.15 48.35 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.686 0.755 . . . . 1.06 109.054 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.622 ' OE2' ' HA ' ' B' ' 287' ' ' ARG . 2.4 tt0 -98.25 22.52 9.47 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.417 -0.811 . . . . 1.58 111.047 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.741 ' HB ' ' CB ' ' B' ' 288' ' ' ALA . 9.1 p -154.07 -36.65 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.205 0 N-CA-C 113.627 0.973 . . . . 0.82 113.627 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -89.77 91.18 8.53 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.243 -0.583 . . . . 0.7 109.524 179.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.36 -24.91 67.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.197 -0.91 . . . . 0.9 113.364 -178.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -75.58 -10.95 59.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.93 0.395 . . . . 0.85 110.66 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.08 48.59 68.98 Favored Glycine 0 CA--C 1.519 0.312 0 CA-C-N 116.077 -0.51 . . . . 1.03 114.128 178.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -128.87 -27.79 2.5 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.198 0.523 . . . . 1.61 110.027 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.73 17.88 36.97 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.78 -0.645 . . . . 0.67 113.2 178.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 2.0 m -141.75 139.99 32.98 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.886 0.343 . . . . 0.65 110.808 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.669 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.9 OUTLIER -124.56 118.92 54.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.119 0.485 . . . . 0.5 111.202 179.879 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -93.01 -167.14 1.67 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.368 -0.833 . . . . 1.09 110.472 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.48 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 28.3 m-85 -57.97 -53.32 67.0 Favored Pre-proline 0 CA--C 1.54 0.592 0 C-N-CA 122.936 0.494 . . . . 1.78 112.292 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.3 Cg_endo -57.53 -36.44 98.66 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.991 1.794 . . . . 0.79 112.026 179.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.401 ' HB2' HG23 ' A' ' 63' ' ' ILE . 31.1 mt-10 -72.14 -39.48 68.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.526 -0.761 . . . . 0.66 110.943 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -66.12 -37.47 85.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.245 -0.434 . . . . 0.77 109.835 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.606 ' O ' ' HB3' ' A' ' 73' ' ' ALA . 35.8 mt -63.71 -32.64 74.2 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.817 -0.629 . . . . 0.9 110.286 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.5 m -92.31 11.07 27.13 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.95 -0.568 . . . . 1.02 110.644 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.7 tpt -119.15 -68.25 0.93 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.369 -0.378 . . . . 0.69 111.181 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -17.68 63.39 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.735 0.303 . . . . 0.99 111.727 -178.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.606 ' HB3' ' O ' ' A' ' 69' ' ' LEU . . . -104.06 9.47 36.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.918 0.39 . . . . 1.21 110.459 179.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.235 0.319 0 CA-C-N 116.27 -0.423 . . . . 2.56 111.833 -178.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . 0.622 ' HA ' ' OE2' ' A' ' 54' ' ' GLU . 1.7 tpm_? . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 109.441 -0.578 . . . . 3.11 109.441 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.741 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -61.4 -28.16 69.05 Favored 'General case' 0 C--O 1.214 -0.815 0 N-CA-C 113.295 0.85 . . . . 0.6 113.295 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . 0.548 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -70.59 1.3 5.36 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.03 0.752 . . . . 0.65 113.03 -179.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -115.95 -37.28 3.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 122.847 1.308 . . . . 0.87 109.431 176.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 25.6 mt -80.52 -7.14 59.09 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 113.245 -1.798 . . . . 1.37 110.662 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.682 ' CE2' HG21 ' A' ' 55' ' ' VAL . 5.0 m0 -93.81 -53.88 0.24 Allowed Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 107.355 -1.35 . . . . 0.42 107.355 174.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.548 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 21.5 Cg_exo -50.94 -37.11 55.58 Favored 'Trans proline' 0 C--N 1.367 1.508 0 C-N-CA 122.578 2.185 . . . . 0.54 113.029 175.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . . . . . . . . . 1.4 t -59.67 -60.82 9.34 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-O 119.34 -0.362 . . . . 0.95 110.346 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.407 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 85.2 Cg_exo -51.14 -38.4 60.36 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 122.203 1.935 . . . . 0.54 112.091 176.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 9.5 tp -64.65 -36.73 85.21 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.824 0.345 . . . . 0.56 110.345 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 17.5 ttt -66.43 -41.66 88.87 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.499 0.666 . . . . 1.79 109.285 177.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 20.4 mm -62.93 -35.6 72.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 108.447 -0.946 . . . . 0.5 108.447 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . 0.504 ' HE3' ' CG ' ' A' ' 14' ' ' GLU . 0.2 OUTLIER -66.35 -40.86 90.08 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.88 -1.054 . . . . 0.51 109.381 178.08 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 73.1 mtt180 -63.34 -40.01 96.11 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.198 -0.455 . . . . 2.44 110.101 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 66.2 m -64.71 -42.78 95.01 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.842 -0.617 . . . . 0.66 109.782 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -69.06 -36.9 78.18 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.119 -0.491 . . . . 2.44 110.561 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 3.3 tttp -63.81 -33.08 74.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.815 0.817 . . . . 0.82 109.197 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -81.61 -21.76 38.1 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.699 -1.137 . . . . 1.16 110.81 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.251 1.161 0 CA-C-O 118.575 -0.726 . . . . 1.39 110.265 179.083 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 . . . . . 0 N--CA 1.464 0.237 0 CA-C-O 120.984 0.421 . . . . 1.18 111.265 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -82.45 -38.4 24.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 1.27 110.445 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.419 ' HA ' ' CE2' ' A' ' 16' ' ' PHE . 38.2 mtmt -69.62 -13.9 62.55 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.372 0.606 . . . . 0.99 110.335 179.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -73.19 -17.06 61.4 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.277 -0.874 . . . . 1.29 110.696 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.638 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -69.9 -32.82 71.34 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.341 0.591 . . . . 0.58 110.377 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.419 ' CE2' ' HA ' ' A' ' 13' ' ' LYS . 12.6 m-85 -79.92 5.33 14.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.856 -0.611 . . . . 0.98 111.505 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -124.94 -47.56 1.79 Allowed 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 121.049 -0.261 . . . . 0.73 110.99 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.417 ' HB2' ' CG ' ' B' ' 299' ' ' LYS . 35.8 mt -93.22 -38.96 11.27 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 111.866 0.321 . . . . 0.55 111.866 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.638 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 92.0 t80 -74.4 -42.15 59.73 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.861 0.362 . . . . 0.79 110.898 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -87.31 136.56 32.89 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.286 -0.416 . . . . 0.59 110.671 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -106.35 -11.63 15.92 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.145 0.424 . . . . 1.57 112.145 -178.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.87 -40.76 11.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.155 0.502 . . . . 0.82 110.655 -179.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.07 16.72 15.82 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 110.922 -0.871 . . . . 0.87 110.922 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -96.86 -21.42 17.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.892 0.377 . . . . 0.74 111.02 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.8 -46.11 3.41 Favored Glycine 0 C--O 1.227 -0.291 0 C-N-CA 121.085 -0.579 . . . . 1.3 114.269 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.39 129.84 29.64 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 117.046 0.423 . . . . 0.66 111.622 -179.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.405 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 54.4 mt -83.73 115.79 26.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-O 121.362 0.601 . . . . 0.5 111.838 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -126.49 171.86 10.7 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 114.884 -1.053 . . . . 0.77 109.861 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.509 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -57.09 -27.68 61.97 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.742 0.645 . . . . 0.59 112.742 179.405 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -68.1 -39.09 82.91 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.173 0.435 . . . . 0.56 112.173 -178.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 -84.92 -19.22 32.56 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 121.957 -0.464 . . . . 0.87 110.96 -178.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.474 HD21 ' CE ' ' A' ' 51' ' ' MET . 20.4 tp -79.13 -41.2 29.1 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.894 -0.594 . . . . 0.47 110.237 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.33 -28.46 55.68 Favored Glycine 0 C--O 1.226 -0.372 0 C-N-CA 120.946 -0.645 . . . . 0.36 113.843 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.83 -25.66 68.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 117.419 0.61 . . . . 0.47 111.288 -179.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.2 t -80.31 -55.69 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 N-CA-C 109.573 -0.528 . . . . 1.38 109.573 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 33.7 mtt -54.47 -39.62 67.65 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.149 0.499 . . . . 0.85 111.035 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -62.4 -38.44 89.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.576 -0.738 . . . . 1.95 111.867 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.2 m -93.12 2.45 56.71 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.078 0.466 . . . . 0.59 111.796 -177.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.0 tp -109.35 -57.91 2.1 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.835 -0.621 . . . . 0.72 110.773 -179.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -145.8 44.61 0.85 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 119.988 -1.101 . . . . 0.56 113.323 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 73.08 140.62 0.06 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.68 0.752 . . . . 2.83 111.834 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -81.68 138.05 47.43 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.384 -0.825 . . . . 0.96 110.496 -179.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.72 -165.55 0.3 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.804 2.336 . . . . 0.61 112.862 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 68.6 p -79.3 161.82 26.02 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.949 -0.389 . . . . 0.8 109.949 178.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -59.27 -36.95 76.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.788 0.327 . . . . 2.13 110.483 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.3 -47.13 80.66 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.408 -0.36 . . . . 0.7 110.175 179.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -63.25 -40.95 98.85 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.119 0.485 . . . . 0.81 110.282 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.509 ' HG ' HG22 ' A' ' 29' ' ' THR . 55.3 tp -59.03 -43.6 91.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.444 -0.798 . . . . 0.76 111.072 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.508 ' O ' HG22 ' A' ' 52' ' ' ILE . 19.1 tt0 -75.74 -35.06 60.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.044 -0.525 . . . . 1.12 111.665 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -68.04 -25.42 65.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.925 0.393 . . . . 1.42 110.844 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.509 ' O ' HG12 ' A' ' 55' ' ' VAL . 1.9 mmm -64.37 -44.96 89.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.364 -0.38 . . . . 0.54 110.068 179.498 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.517 ' HA ' ' CG1' ' A' ' 55' ' ' VAL . 6.9 tp -70.92 -21.35 22.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.077 0.465 . . . . 0.59 109.976 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -78.21 -17.73 56.36 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.994 -0.743 . . . . 1.06 108.994 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.521 ' HG3' ' H ' ' B' ' 288' ' ' ALA . 19.3 tp10 -95.81 -0.67 50.91 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.418 -0.81 . . . . 1.58 111.239 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.713 HG21 ' CE2' ' B' ' 292' ' ' TRP . 1.0 OUTLIER -122.22 -46.27 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 N-CA-C 112.177 0.436 . . . . 0.82 112.177 -179.756 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -76.52 99.75 5.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.41 0.624 . . . . 0.7 111.288 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.71 -22.62 46.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.182 -0.917 . . . . 0.9 111.425 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -76.56 -0.78 24.44 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.194 -0.457 . . . . 0.85 111.967 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.97 46.37 84.45 Favored Glycine 0 C--O 1.224 -0.487 0 C-N-CA 121.554 -0.355 . . . . 1.03 113.977 178.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -127.46 -17.66 4.6 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.419 0.628 . . . . 1.61 109.697 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 76.64 24.08 68.43 Favored Glycine 0 N--CA 1.452 -0.238 0 CA-C-N 115.537 -0.756 . . . . 0.67 112.921 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.0 m -151.75 146.71 25.94 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.938 0.399 . . . . 0.65 110.552 179.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.479 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 0.9 OUTLIER -123.93 109.07 22.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.283 0.564 . . . . 0.5 110.023 179.12 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -78.81 -176.65 5.07 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.296 -0.866 . . . . 1.09 110.062 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.493 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 74.8 m-85 -57.72 -53.63 63.66 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 116.262 -0.426 . . . . 1.78 111.309 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 10.5 Cg_endo -56.23 -35.72 95.87 Favored 'Trans proline' 0 C--N 1.357 0.976 0 C-N-CA 122.497 2.131 . . . . 0.79 112.138 178.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.412 ' HB2' HG23 ' A' ' 63' ' ' ILE . 36.9 mt-10 -69.45 -39.21 77.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.164 -0.471 . . . . 0.66 110.047 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -59.66 -39.22 83.71 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.57 -0.741 . . . . 0.77 111.239 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 94.4 mt -64.29 -36.6 84.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.249 0.547 . . . . 0.9 110.599 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.6 m -80.41 -39.6 28.03 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.702 -0.681 . . . . 1.02 111.333 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 7.3 tpt -62.69 -54.45 39.21 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.85 -0.614 . . . . 0.69 112.056 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -4.61 30.24 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.708 0.632 . . . . 0.99 112.708 -177.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -101.48 2.9 39.74 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.995 0.426 . . . . 1.21 110.287 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.442 HH11 ' HD3' ' A' ' 74' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.327 -0.384 0 CA-C-N 116.038 -0.528 . . . . 2.56 111.051 -179.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . 0.421 ' HB3' ' OD1' ' B' ' 290' ' ' ASN . 4.4 ttm180 . . . . . 0 N--CA 1.477 0.91 0 N-CA-C 109.858 -0.423 . . . . 3.11 109.858 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.579 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -67.26 -20.44 65.66 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 112.568 0.581 . . . . 0.6 112.568 -178.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . 0.573 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -72.06 -3.49 23.31 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-O 121.356 0.598 . . . . 0.65 112.111 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . 0.421 ' OD1' ' HB3' ' B' ' 287' ' ' ARG . 3.2 m120 -111.86 -33.76 6.21 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 122.578 1.18 . . . . 0.87 109.893 175.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . 0.415 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 8.1 mp -79.74 -13.11 59.68 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 114.267 -1.333 . . . . 1.37 110.283 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.713 ' CE2' HG21 ' A' ' 55' ' ' VAL . 3.4 m0 -86.88 -54.65 0.38 Allowed Pre-proline 0 CA--C 1.531 0.222 0 N-CA-C 107.385 -1.339 . . . . 0.42 107.385 175.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.573 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 18.3 Cg_exo -49.23 -33.21 27.45 Favored 'Trans proline' 0 C--N 1.366 1.465 0 C-N-CA 122.631 2.221 . . . . 0.54 112.812 174.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.586 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 13.7 t -58.22 -63.43 3.96 Favored Pre-proline 0 CA--C 1.547 0.837 0 CA-C-O 118.999 -0.524 . . . . 0.95 110.847 179.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.586 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 76.1 Cg_exo -52.22 -35.82 64.86 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 122.243 1.962 . . . . 0.54 112.236 176.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 18.7 tp -69.09 -31.42 70.13 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.054 0.454 . . . . 0.56 109.782 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . 0.404 ' O ' ' HB2' ' B' ' 300' ' ' ARG . 15.5 ttt -71.73 -42.55 67.15 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.175 -1.046 . . . . 1.79 108.175 178.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 42.0 mm -62.74 -33.14 58.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 107.94 -1.133 . . . . 0.5 107.94 176.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . 0.454 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.1 OUTLIER -64.31 -36.92 85.69 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 108.66 -0.867 . . . . 0.51 108.66 177.664 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . 0.404 ' HB2' ' O ' ' B' ' 297' ' ' MET . 44.5 mtt180 -66.7 -36.24 82.02 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.742 -0.836 . . . . 2.44 108.742 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 12.8 m -66.9 -38.33 86.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.973 -1.012 . . . . 0.66 109.275 178.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.45 -35.41 65.75 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.105 -0.702 . . . . 2.44 109.105 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -66.72 -36.06 81.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.399 0.619 . . . . 0.82 109.439 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -72.17 -39.92 68.32 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.197 -0.91 . . . . 1.16 109.145 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 8.4 m . . . . . 0 C--O 1.252 1.2 0 CA-C-O 118.239 -0.886 . . . . 1.39 110.149 179.356 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.214 0 CA-C-O 120.86 0.362 . . . . 2.58 110.387 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.402 ' O ' HG23 ' A' ' 5' ' ' THR . 28.0 m-20 -90.14 50.36 1.85 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.156 -0.475 . . . . 3.47 110.29 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.5 -51.86 56.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.213 -0.448 . . . . 2.95 110.515 -179.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.7 mt -89.93 77.67 6.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.011 0.434 . . . . 1.97 109.93 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.402 HG23 ' O ' ' A' ' 2' ' ' ASP . 0.8 OUTLIER -80.14 -85.09 0.09 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.824 -0.625 . . . . 1.68 111.022 -179.868 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 54.39 56.29 7.07 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.665 0.745 . . . . 1.44 109.965 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -116.2 -52.43 2.59 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.219 -0.9 . . . . 1.35 110.128 -178.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -97.7 -34.77 10.79 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.252 -0.885 . . . . 1.61 109.394 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.466 ' HA ' ' CD2' ' A' ' 12' ' ' PHE . 3.1 mt -57.26 -26.95 26.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 114.983 -1.008 . . . . 1.23 111.721 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.98 -25.83 68.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.166 0.508 . . . . 0.98 110.895 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -85.02 -21.26 29.51 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.983 -0.553 . . . . 1.18 111.551 -179.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.466 ' CD2' ' HA ' ' A' ' 9' ' ' ILE . 20.3 m-85 -74.49 -40.93 61.53 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.08 -0.711 . . . . 1.27 109.08 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -68.43 -22.36 64.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.455 -0.793 . . . . 0.99 110.331 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.4 ' CG ' ' HE3' ' B' ' 299' ' ' LYS . 5.1 tp10 -69.62 -27.12 64.81 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.653 -0.703 . . . . 1.29 110.478 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.32 -47.6 85.19 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.673 -0.491 . . . . 0.58 109.673 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -73.89 3.46 6.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.069 0.462 . . . . 0.98 111.61 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.4 m -112.76 -35.0 5.62 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.258 -0.428 . . . . 0.73 111.886 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.433 HD12 ' HG2' ' B' ' 299' ' ' LYS . 79.4 mt -105.13 -26.44 12.09 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.144 0.424 . . . . 0.55 112.144 -178.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -83.0 -49.06 9.97 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 121.043 -0.263 . . . . 0.79 111.318 -178.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.64 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 32.5 t70 -92.24 140.02 30.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.955 0.407 . . . . 0.59 111.166 -179.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -125.43 3.44 7.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.0 -0.545 . . . . 1.57 110.5 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.618 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 4.2 m-20 -90.17 -28.6 18.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.161 0.505 . . . . 0.82 109.976 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.89 27.7 9.34 Favored Glycine 0 N--CA 1.444 -0.784 0 N-CA-C 111.118 -0.793 . . . . 0.87 111.118 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -100.48 -31.54 11.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.305 -0.448 . . . . 0.74 111.126 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 69.45 36.99 78.58 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.867 -0.683 . . . . 1.3 112.085 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.4 HG22 ' HA ' ' A' ' 64' ' ' ASP . 5.3 p -139.4 152.96 47.52 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.823 -0.436 . . . . 0.66 109.823 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.444 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 74.5 mt -101.86 111.52 31.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-O 120.975 0.417 . . . . 0.5 110.936 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.7 p -118.71 -178.93 3.66 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.913 -0.773 . . . . 0.77 108.913 178.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.27 -30.45 60.13 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.288 -0.414 . . . . 0.59 111.739 178.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -64.71 -46.43 82.35 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.949 -0.568 . . . . 0.56 112.313 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.647 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 50.4 mp0 -81.88 -25.87 34.66 Favored 'General case' 0 C--N 1.332 -0.165 0 O-C-N 121.903 -0.498 . . . . 0.87 111.095 -177.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.5 tp -71.51 -33.55 69.32 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.531 -0.758 . . . . 0.47 110.755 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -91.41 -29.22 12.62 Favored Glycine 0 C--O 1.229 -0.187 0 C-N-CA 120.651 -0.785 . . . . 0.36 113.908 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -60.67 -40.73 93.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 117.354 0.577 . . . . 0.47 112.483 -178.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.411 HG11 ' HB3' ' B' ' 295' ' ' PRO . 7.3 p -67.5 -48.21 77.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 121.047 -0.261 . . . . 1.38 110.661 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 43.6 mtt -61.24 -36.63 80.49 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.784 0.326 . . . . 0.85 110.432 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 -56.58 -33.29 66.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.243 -0.89 . . . . 1.95 111.639 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 m -112.38 24.79 12.15 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.178 0.513 . . . . 0.59 111.019 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 22.7 tp -125.6 -49.02 1.65 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.031 -0.531 . . . . 0.72 111.124 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -155.5 43.7 0.55 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 121.015 -0.612 . . . . 0.56 112.214 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 71.67 143.32 0.06 Allowed 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.368 0.667 . . . . 2.83 111.165 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -88.05 133.0 38.12 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.703 -0.68 . . . . 0.96 110.822 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -74.54 -177.34 3.28 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.719 2.28 . . . . 0.61 111.307 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.3 p -78.39 165.15 24.15 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.877 -0.329 . . . . 0.8 110.719 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -57.52 -40.88 79.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.895 0.378 . . . . 2.13 110.957 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.07 -45.53 92.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.7 110.809 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -63.41 -36.55 84.12 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.443 -0.799 . . . . 0.81 111.059 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.7 tp -72.36 -38.29 68.6 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.266 -0.425 . . . . 0.76 110.174 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -59.89 -46.2 90.11 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.594 -0.73 . . . . 1.12 110.316 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -64.52 -37.1 86.37 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.498 -0.774 . . . . 1.42 110.792 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.491 ' O ' HG12 ' A' ' 55' ' ' VAL . 4.1 mmm -63.42 -46.41 86.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.905 -0.588 . . . . 0.54 112.504 -178.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 8.4 tp -72.1 -25.97 24.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 120.536 -0.466 . . . . 0.59 110.153 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -75.13 -21.74 58.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.65 0.738 . . . . 1.06 109.667 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.591 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 24.0 tt0 -84.08 -7.09 59.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.855 -1.066 . . . . 1.58 111.058 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.748 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -118.29 -48.95 3.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.451 -0.341 . . . . 0.82 111.234 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.623 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 19.7 t70 -75.01 101.43 4.48 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.781 0.324 . . . . 0.7 110.296 -179.482 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -7.86 56.09 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.044 -0.526 . . . . 0.9 111.535 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.02 -27.85 39.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.989 0.423 . . . . 0.85 111.094 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 92.99 44.8 3.75 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.681 -0.771 . . . . 1.03 114.705 177.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -144.61 -11.97 0.59 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.282 0.541 . . . . 1.61 111.138 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 75.49 26.08 66.44 Favored Glycine 0 C--N 1.33 0.239 0 C-N-CA 120.701 -0.761 . . . . 0.67 112.582 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 93.8 m -138.89 134.83 33.77 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.097 0.475 . . . . 0.65 110.97 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.519 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 0.4 OUTLIER -119.38 119.31 60.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.553 -0.748 . . . . 0.5 110.313 178.59 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.4 ' HA ' HG22 ' A' ' 26' ' ' THR . 3.6 t70 -95.08 -173.17 2.88 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.646 -0.706 . . . . 1.09 110.043 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.519 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 15.1 m-85 -56.6 -52.97 69.4 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.368 -0.378 . . . . 1.78 111.498 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.7 Cg_endo -54.21 -37.2 87.79 Favored 'Trans proline' 0 C--N 1.364 1.365 0 C-N-CA 122.622 2.215 . . . . 0.79 112.258 178.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.648 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 29.1 mt-10 -72.95 -46.01 54.83 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.193 0.52 . . . . 0.66 110.481 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -59.29 -37.46 77.74 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.3 -0.864 . . . . 0.77 111.041 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 62.9 mt -59.65 -30.02 68.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.993 -0.549 . . . . 0.9 111.808 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.82 -37.6 10.67 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.194 0.521 . . . . 1.02 110.987 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.56 ' HE1' ' HA ' ' B' ' 289' ' ' ALA . 14.4 tpt -59.96 -48.94 79.63 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.596 -0.729 . . . . 0.69 112.102 -179.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.87 26.09 1.63 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.88 0.326 . . . . 0.99 111.88 -178.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -132.02 -36.85 1.16 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.998 0.428 . . . . 1.21 111.342 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -83.31 63.68 7.38 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.766 0.317 . . . . 2.56 111.733 -178.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.4 ptmm? -73.78 138.69 44.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.259 -0.428 . . . . 3.25 110.374 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -69.61 168.86 13.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.411 -0.359 . . . . 2.59 110.311 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -84.03 -16.61 43.29 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.08 0.467 . . . . 2.45 110.589 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -103.65 139.55 38.78 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.569 -0.53 . . . . 2.35 109.569 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.2 m -110.87 136.66 49.57 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.927 -0.579 . . . . 3.14 110.721 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 . . . . . 0 C--O 1.254 1.339 0 CA-C-O 118.557 -0.735 . . . . 3.21 110.343 -179.878 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . 0.591 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 110.28 -0.267 . . . . 3.11 110.28 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.531 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . . . -59.93 -31.32 69.74 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-O 120.715 0.293 . . . . 0.6 110.753 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . 0.56 ' HA ' ' HE1' ' A' ' 71' ' ' MET . . . -68.57 -14.08 62.77 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 120.844 -0.342 . . . . 0.65 111.435 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . 0.496 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 3.5 m120 -102.68 -38.97 7.25 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.01 0.909 . . . . 0.87 109.292 175.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 1.1 mp -73.57 -10.28 59.55 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.944 -0.571 . . . . 1.37 111.155 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.748 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 2.6 m0 -87.15 -52.66 0.41 Allowed Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 107.766 -1.198 . . . . 0.42 107.766 175.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.516 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 12.8 Cg_exo -51.55 -33.82 49.66 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 123.454 2.77 . . . . 0.54 112.903 174.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.585 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 14.4 t -58.1 -60.11 11.13 Favored Pre-proline 0 CA--C 1.547 0.845 0 CA-C-O 119.203 -0.427 . . . . 0.95 110.903 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.585 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 78.8 Cg_exo -55.61 -34.37 89.94 Favored 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 122.025 1.816 . . . . 0.54 111.887 176.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 9.4 tp -65.35 -33.66 76.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.187 0.517 . . . . 0.56 109.745 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 2.7 ttt -67.84 -32.99 73.9 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.472 -0.936 . . . . 1.79 108.472 177.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 48.5 mm -69.99 -37.2 71.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.343 -0.984 . . . . 0.5 108.343 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . 0.564 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.1 OUTLIER -63.45 -42.23 98.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.169 -0.923 . . . . 0.51 109.264 178.092 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -40.34 94.38 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.258 -0.645 . . . . 2.44 109.258 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 53.7 m -64.54 -39.25 93.41 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.712 -0.676 . . . . 0.66 110.022 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -69.69 -34.61 74.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.086 -0.506 . . . . 2.44 109.89 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -66.44 -28.46 68.62 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.711 0.767 . . . . 0.82 109.503 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -85.5 -36.65 20.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.965 -1.016 . . . . 1.16 109.984 178.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 11.7 m . . . . . 0 C--O 1.255 1.35 0 CA-C-O 118.845 -0.598 . . . . 1.39 110.039 179.083 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' ' CA' . . . . . 0.647 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' ' CA' . . . . . 0.648 'CA ' ' OE1' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.429 ' HB3' ' OE1' ' A' ' 3' ' ' GLN . . . . . . . . 0 N--CA 1.475 0.776 0 N-CA-C 109.595 -0.52 . . . . 2.58 109.595 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -80.93 85.73 6.18 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.113 0.482 . . . . 3.47 111.72 -179.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.429 ' OE1' ' HB3' ' A' ' 1' ' ' ALA . 8.2 mp0 -129.26 -77.22 0.55 Allowed 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.145 -0.687 . . . . 2.95 109.145 178.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.9 mt -92.07 51.77 1.86 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.441 -0.8 . . . . 1.97 110.657 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.44 -71.82 0.23 Allowed 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.704 -0.68 . . . . 1.68 110.42 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 42.82 67.0 0.67 Allowed 'General case' 0 N--CA 1.47 0.527 0 O-C-N 123.722 0.639 . . . . 1.44 111.014 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.14 -54.34 2.01 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.745 0.307 . . . . 1.35 111.704 -178.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -88.47 -29.15 20.37 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.071 -0.513 . . . . 1.61 110.79 -178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.466 ' H ' HG13 ' A' ' 9' ' ' ILE . 2.0 mt -56.26 -21.47 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-N 115.73 -0.668 . . . . 1.23 111.82 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.01 -34.63 68.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.876 -0.602 . . . . 0.98 112.061 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -86.11 -21.47 27.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.709 -0.223 . . . . 1.18 111.398 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -71.23 -42.68 68.57 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 120.993 0.425 . . . . 1.27 111.537 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 80.1 mttt -68.73 -19.81 64.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.084 -0.507 . . . . 0.99 110.049 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.44 ' HG3' ' CD1' ' A' ' 18' ' ' LEU . 2.2 tp10 -69.61 -30.79 68.61 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.455 -0.793 . . . . 1.29 110.295 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.512 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -61.04 -46.0 92.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.297 -0.411 . . . . 0.58 110.113 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -84.52 29.29 0.6 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.107 0.48 . . . . 0.98 110.779 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.7 m -137.06 -38.17 0.63 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.947 -0.569 . . . . 0.73 110.712 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.457 HD12 ' HG2' ' B' ' 299' ' ' LYS . 23.3 mt -109.46 -37.91 5.6 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 111.998 0.37 . . . . 0.55 111.998 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.512 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 78.1 t80 -67.26 -43.45 81.83 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.817 0.341 . . . . 0.79 110.396 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.638 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 25.5 t70 -92.29 144.62 25.21 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.002 -0.74 . . . . 0.59 109.002 178.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -119.37 -2.58 10.58 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.784 -0.367 . . . . 1.57 111.761 -178.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.596 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 0.3 OUTLIER -93.23 -42.0 9.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.034 0.445 . . . . 0.82 110.547 -178.541 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 119.48 0.49 13.98 Favored Glycine 0 N--CA 1.442 -0.964 0 CA-C-N 115.456 -0.793 . . . . 0.87 111.651 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -75.61 -46.61 30.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.79 0.329 . . . . 0.74 111.155 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.99 26.22 41.96 Favored Glycine 0 CA--C 1.518 0.267 0 CA-C-N 116.264 -0.425 . . . . 1.3 112.295 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.9 152.05 31.34 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 110.4 -0.222 . . . . 0.66 110.4 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.564 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 10.7 mt -94.53 105.83 17.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.395 0.617 . . . . 0.5 110.802 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.86 165.84 17.33 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 114.786 -1.097 . . . . 0.77 109.215 178.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.82 -33.94 51.53 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.239 0.459 . . . . 0.59 112.239 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -61.85 -46.08 91.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.083 -0.508 . . . . 0.56 112.043 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.66 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 48.7 mp0 -77.12 -25.01 51.65 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.886 0.374 . . . . 0.87 110.95 -178.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.472 HD21 ' HE2' ' A' ' 51' ' ' MET . 18.3 tp -76.23 -47.25 24.63 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 116.031 -0.532 . . . . 0.47 110.271 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.99 -36.83 86.96 Favored Glycine 0 C--N 1.333 0.371 0 CA-C-N 115.637 -0.711 . . . . 0.36 114.091 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 p -59.94 -31.49 69.91 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 117.285 0.543 . . . . 0.47 112.406 -178.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.8 t -72.93 -53.42 18.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.811 -0.44 . . . . 1.38 109.811 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 23.9 mtt -58.73 -41.22 85.89 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.734 -0.666 . . . . 0.85 111.457 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.454 ' HG3' ' HB2' ' A' ' 42' ' ' ASN . 1.1 ttt180 -59.49 -43.06 93.42 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.373 -0.376 . . . . 1.95 111.059 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 69.0 m -85.33 -3.69 58.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.978 0.418 . . . . 0.59 111.848 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.0 tp -100.93 -62.13 1.28 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.806 0.336 . . . . 0.72 111.295 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -149.08 62.97 0.41 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.528 -0.844 . . . . 0.56 112.726 -178.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 69.5 158.64 0.17 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.579 0.704 . . . . 2.83 112.043 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.454 ' HB2' ' HG3' ' A' ' 37' ' ' ARG . 3.9 t30 -105.94 135.01 19.48 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.838 -0.619 . . . . 0.96 110.57 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -75.95 -168.04 0.51 Allowed 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.344 2.029 . . . . 0.61 111.45 178.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.5 p -80.39 165.92 21.77 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 110.311 -0.255 . . . . 0.8 110.311 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -65.19 -32.72 74.54 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.556 -0.535 . . . . 2.13 109.556 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.5 -50.09 71.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.726 -0.67 . . . . 0.7 110.15 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -64.92 -33.94 77.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.774 -0.648 . . . . 0.81 110.606 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 47.8 tp -62.81 -38.35 90.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.467 -0.788 . . . . 0.76 110.358 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.564 ' O ' HG22 ' A' ' 52' ' ' ILE . 6.6 tt0 -77.74 -42.07 35.53 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.885 -0.598 . . . . 1.12 110.123 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -59.51 -29.41 67.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.189 0.518 . . . . 1.42 110.455 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.472 ' HE2' HD21 ' A' ' 32' ' ' LEU . 1.7 mmm -69.21 -35.38 76.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.916 -0.584 . . . . 0.54 110.853 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 49' ' ' GLN . 5.0 tp -80.85 -13.09 12.8 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-O 121.467 0.651 . . . . 0.59 109.546 179.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -81.16 -27.18 35.54 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.497 -0.774 . . . . 1.06 109.32 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.609 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 22.3 tt0 -94.41 36.37 1.16 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.584 -0.734 . . . . 1.58 110.274 178.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.809 ' HB ' ' HB3' ' B' ' 288' ' ' ALA . 7.1 p -164.59 -32.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 C-N-CA 119.965 -0.694 . . . . 0.82 112.592 -177.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -93.09 80.13 4.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.99 0.424 . . . . 0.7 110.303 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.72 -28.46 61.05 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.55 -0.75 . . . . 0.9 112.791 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -69.48 -14.48 62.9 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.881 0.372 . . . . 0.85 110.828 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.55 51.48 58.47 Favored Glycine 0 C--N 1.333 0.373 0 CA-C-N 116.277 -0.42 . . . . 1.03 113.044 178.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -124.29 -25.7 4.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.17 0.51 . . . . 1.61 110.376 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.2 14.59 47.83 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.799 -0.637 . . . . 0.67 111.891 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.5 m -152.42 139.06 18.75 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 120.995 0.426 . . . . 0.65 111.379 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.647 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.4 OUTLIER -116.13 118.52 59.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 108.737 -0.838 . . . . 0.5 108.737 178.347 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -91.81 -172.39 3.18 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.645 -0.502 . . . . 1.09 109.645 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.491 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 31.0 m-85 -55.88 -53.92 57.8 Favored Pre-proline 0 CA--C 1.532 0.263 0 O-C-N 123.085 0.24 . . . . 1.78 111.17 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.7 Cg_endo -50.93 -43.18 48.86 Favored 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 122.236 1.957 . . . . 0.79 112.02 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.652 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 20.2 mt-10 -69.69 -43.22 72.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.362 -0.381 . . . . 0.66 110.759 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -56.77 -40.98 76.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.833 -0.621 . . . . 0.77 111.335 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.29 -34.75 77.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.686 -0.688 . . . . 0.9 110.7 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.7 m -81.79 -41.82 20.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.132 -0.485 . . . . 1.02 111.137 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.473 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 5.6 tpt -61.92 -50.09 73.58 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.516 0.562 . . . . 0.69 112.516 -178.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.67 -15.1 61.71 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.12 -0.632 . . . . 0.99 112.367 -178.162 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -96.69 -13.16 22.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.141 0.496 . . . . 1.21 110.262 178.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -82.82 66.7 8.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.741 -0.663 . . . . 2.56 110.307 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -79.06 143.05 35.97 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.89 -0.596 . . . . 3.25 111.001 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 3.0 mpp? -104.27 158.16 16.64 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.835 -0.621 . . . . 2.59 110.935 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -90.04 2.95 54.61 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.855 -0.611 . . . . 2.45 109.839 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.43 153.74 43.08 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.626 -0.716 . . . . 2.35 110.261 -178.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.4 m -81.41 101.39 9.82 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.941 -0.572 . . . . 3.14 109.954 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.328 -0.844 . . . . 3.21 110.02 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . 0.609 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 5.2 ttm180 . . . . . 0 N--CA 1.477 0.899 0 CA-C-O 120.718 0.294 . . . . 3.11 110.556 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.809 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -63.21 -31.61 72.8 Favored 'General case' 0 C--O 1.216 -0.709 0 N-CA-C 112.621 0.6 . . . . 0.6 112.621 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . 0.529 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -63.64 -3.52 2.31 Favored 'General case' 0 C--O 1.216 -0.658 0 N-CA-C 113.335 0.865 . . . . 0.65 113.335 -179.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -111.42 -35.97 5.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 122.286 1.041 . . . . 0.87 109.973 177.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . 0.4 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 8.2 mp -80.22 -8.36 59.41 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 114.077 -1.419 . . . . 1.37 109.979 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.69 ' CE2' HG21 ' A' ' 55' ' ' VAL . 6.5 m0 -90.72 -54.56 0.28 Allowed Pre-proline 0 CA--C 1.535 0.394 0 N-CA-C 107.176 -1.416 . . . . 0.42 107.176 175.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.539 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 21.4 Cg_exo -50.77 -32.81 38.16 Favored 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 122.751 2.301 . . . . 0.54 112.571 174.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.572 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 19.5 t -59.78 -61.76 7.24 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-O 119.124 -0.465 . . . . 0.95 110.688 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.572 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 93.1 Cg_exo -52.06 -36.23 64.77 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 121.594 1.529 . . . . 0.54 112.215 176.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 14.2 tp -65.21 -32.68 74.48 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.347 0.594 . . . . 0.56 109.735 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 17.7 ttt -73.31 -45.36 55.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.208 -0.906 . . . . 1.79 108.926 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 46.2 mm -61.1 -33.65 56.92 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 N-CA-C 108.881 -0.785 . . . . 0.5 108.881 178.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . 0.567 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.2 OUTLIER -62.95 -43.85 97.65 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.18 -0.918 . . . . 0.51 109.105 178.21 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -41.62 89.7 Favored 'General case' 0 C--N 1.333 -0.113 0 N-CA-C 108.945 -0.761 . . . . 2.44 108.945 178.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 67.9 m -65.01 -42.86 94.06 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.619 -0.719 . . . . 0.66 110.676 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 22.5 tptp -67.49 -36.24 80.72 Favored 'General case' 0 C--O 1.225 -0.219 0 N-CA-C 110.014 -0.365 . . . . 2.44 110.014 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 3.2 tttp -63.48 -30.45 71.57 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.942 -0.762 . . . . 0.82 108.942 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -82.07 -31.59 30.74 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.099 -0.955 . . . . 1.16 109.907 178.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.8 m . . . . . 0 C--O 1.247 0.926 0 CA-C-N 115.453 -0.794 . . . . 1.39 111.216 179.827 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' ' CA' . . . . . 0.66 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' ' CA' . . . . . 0.652 'CA ' ' OE1' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 109.859 -0.423 . . . . 2.58 109.859 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -84.93 103.21 13.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.212 0.53 . . . . 3.47 110.732 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -132.09 -56.46 0.98 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.492 -0.776 . . . . 2.95 110.051 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 73.8 mt -85.12 75.02 10.39 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.204 0.526 . . . . 1.97 110.42 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.86 -85.36 0.06 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.444 -0.798 . . . . 1.68 111.278 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 52.31 50.12 19.05 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.448 0.642 . . . . 1.44 110.151 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.462 ' CD ' ' H ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -116.93 -56.17 2.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.077 -0.965 . . . . 1.35 109.988 -179.22 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.462 ' H ' ' CD ' ' A' ' 7' ' ' GLU . 40.2 mt-30 -93.42 -34.23 13.52 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.094 -0.706 . . . . 1.61 109.094 179.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.441 ' HA ' ' CD2' ' A' ' 12' ' ' PHE . 2.6 mt -63.88 -25.36 38.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.254 -0.885 . . . . 1.23 110.317 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.79 -35.58 81.07 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.351 -0.386 . . . . 0.98 111.265 -179.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.04 -25.83 36.83 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.016 0.436 . . . . 1.18 110.063 179.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.441 ' CD2' ' HA ' ' A' ' 9' ' ' ILE . 22.1 m-30 -69.25 -32.72 72.13 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.439 0.637 . . . . 1.27 109.317 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.8 mttt -70.34 -20.23 63.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.294 -0.866 . . . . 0.99 111.202 179.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.561 ' HG3' HD12 ' A' ' 18' ' ' LEU . 3.7 tp10 -66.94 -24.61 66.1 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 109.181 -0.674 . . . . 1.29 109.181 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 19' ' ' PHE . . . -69.28 -37.42 77.85 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.743 -0.466 . . . . 0.58 109.743 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -86.59 14.98 6.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.883 0.373 . . . . 0.98 110.754 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.3 m -129.03 -35.45 1.84 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.952 0.406 . . . . 0.73 110.914 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.561 HD12 ' HG3' ' A' ' 14' ' ' GLU . 44.6 mt -99.37 -28.55 13.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.277 -0.419 . . . . 0.55 111.938 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.447 ' HB2' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -80.93 -57.6 3.47 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.225 0.536 . . . . 0.79 110.005 -179.012 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.641 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 31.1 t70 -82.4 142.0 32.32 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.004 -0.998 . . . . 0.59 111.146 -179.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -128.89 6.8 5.53 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.104 -0.702 . . . . 1.57 109.104 178.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.624 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 3.9 m-20 -95.08 -25.72 16.34 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.849 -0.614 . . . . 0.82 111.643 -178.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.05 22.14 23.64 Favored Glycine 0 N--CA 1.442 -0.914 0 N-CA-C 110.709 -0.956 . . . . 0.87 110.709 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.636 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 2.5 p30 -95.8 -32.8 12.52 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.641 -0.503 . . . . 0.74 109.641 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.16 28.74 73.82 Favored Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.863 -0.684 . . . . 1.3 112.878 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.5 p -132.35 128.16 37.06 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 122.932 -0.158 . . . . 0.66 111.227 -179.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.474 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 47.9 mt -75.14 112.19 12.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 120.97 0.414 . . . . 0.5 111.379 -179.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.5 p -117.8 177.87 4.61 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.417 -0.811 . . . . 0.77 108.815 178.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.457 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -58.02 -28.24 64.27 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.779 0.323 . . . . 0.59 111.143 178.207 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 44.6 tttt -65.88 -44.63 84.78 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 112.175 0.435 . . . . 0.56 112.175 -179.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.649 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 55.3 mp0 -78.98 -22.03 46.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.95 0.405 . . . . 0.87 111.143 -178.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.4 tp -83.46 -38.66 21.55 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.096 -0.502 . . . . 0.47 110.748 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.18 -32.75 51.45 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.736 -0.745 . . . . 0.36 113.619 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -60.41 -44.91 95.25 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.272 0.471 . . . . 0.47 112.272 -178.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.5 p -66.5 -48.33 80.9 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 120.978 -0.289 . . . . 1.38 110.734 -178.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 56.6 mtt -56.56 -46.38 80.75 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.718 0.294 . . . . 0.85 111.538 178.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -58.39 -29.5 66.09 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.172 -0.467 . . . . 1.95 111.313 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.0 m -99.05 3.88 46.92 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.13 -0.486 . . . . 0.59 111.337 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.5 tp -113.97 -34.14 5.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.314 -0.403 . . . . 0.72 111.408 -178.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -169.3 53.23 0.21 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.225 -0.988 . . . . 0.56 112.829 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 72.89 175.9 0.27 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.495 0.664 . . . . 2.83 111.894 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -116.76 123.72 30.07 Favored Pre-proline 0 C--N 1.318 -0.791 0 CA-C-N 115.273 -0.876 . . . . 0.96 109.56 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -77.48 -163.92 0.24 Allowed 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.162 1.908 . . . . 0.61 111.106 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.6 p -82.55 158.97 22.91 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.01 -0.676 . . . . 0.8 110.195 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.3 mp0 -57.15 -35.28 69.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.97 -0.559 . . . . 2.13 110.533 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.3 -46.14 91.54 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.425 0.631 . . . . 0.7 110.165 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -64.96 -41.11 95.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.216 -0.902 . . . . 0.81 110.37 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.457 ' HG ' HG22 ' A' ' 29' ' ' THR . 18.9 tp -65.05 -43.08 93.48 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.738 -0.664 . . . . 0.76 110.216 179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.476 ' O ' HG22 ' A' ' 52' ' ' ILE . 14.7 tt0 -66.59 -46.76 74.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.288 -0.415 . . . . 1.12 110.66 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -56.18 -35.5 67.31 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.044 0.45 . . . . 1.42 110.741 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.466 ' O ' HG12 ' A' ' 55' ' ' VAL . 2.9 mmm -66.72 -45.96 77.01 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.504 -0.771 . . . . 0.54 111.265 -179.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.476 HG22 ' O ' ' A' ' 49' ' ' GLN . 8.9 tp -69.5 -22.99 25.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-O 121.096 0.474 . . . . 0.59 110.251 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.54 -24.97 41.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.675 0.75 . . . . 1.06 109.193 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.497 ' HB3' ' HB2' ' B' ' 288' ' ' ALA . 9.1 tp10 -77.41 -9.54 58.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.01 -0.995 . . . . 1.58 110.372 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.704 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 0.7 OUTLIER -118.9 -49.72 3.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.292 -0.413 . . . . 0.82 111.849 -179.699 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.647 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 30.2 t70 -79.4 103.8 9.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 0.7 110.841 -178.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.32 -25.69 46.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.867 -0.606 . . . . 0.9 112.598 -178.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -64.14 -39.25 93.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.683 -0.235 . . . . 0.85 111.419 -179.031 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 101.99 31.21 5.46 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.38 -0.914 . . . . 1.03 113.332 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -127.86 -6.04 5.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.84 0.352 . . . . 1.61 110.807 179.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.48 34.69 88.51 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.663 -0.779 . . . . 0.67 112.252 179.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.7 m -142.74 131.69 22.96 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 110.014 -0.365 . . . . 0.65 110.014 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.546 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.1 OUTLIER -113.35 121.71 66.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.141 0.496 . . . . 0.5 111.16 179.662 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -92.43 -176.96 4.47 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.488 -0.778 . . . . 1.09 110.747 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.509 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 36.1 m-85 -52.92 -54.9 38.7 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 116.467 -0.333 . . . . 1.78 111.788 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.8 Cg_endo -59.13 -32.57 97.47 Favored 'Trans proline' 0 C--N 1.36 1.152 0 C-N-CA 122.121 1.881 . . . . 0.79 113.674 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.617 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 38.0 mt-10 -70.39 -42.88 71.12 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.252 0.549 . . . . 0.66 110.296 -178.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -66.68 -44.34 82.01 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.584 -0.734 . . . . 0.77 110.73 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 81.4 mt -59.73 -29.62 68.26 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.427 -0.352 . . . . 0.9 111.409 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.7 m -81.92 -44.6 16.58 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.097 0.406 . . . . 1.02 112.097 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.639 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 24.5 ttt -67.27 -49.73 63.22 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.676 0.621 . . . . 0.69 112.676 -178.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.453 ' HE1' ' HB3' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -74.34 3.45 7.35 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.892 0.701 . . . . 0.99 112.892 -178.122 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -115.44 -11.08 11.88 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.257 0.551 . . . . 1.21 109.997 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.66 58.53 5.09 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.473 -0.785 . . . . 2.56 110.173 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.2 ptmm? -78.15 133.34 37.83 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.983 -0.553 . . . . 3.25 111.391 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 5.2 mpp? -89.32 -175.53 4.78 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.789 -0.641 . . . . 2.59 109.598 179.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -101.17 -4.03 28.0 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.494 -0.928 . . . . 2.45 108.494 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -68.94 145.36 53.7 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 114.297 -1.319 . . . . 2.35 110.377 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.2 m -116.08 104.92 12.04 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.136 -0.484 . . . . 3.14 110.84 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 C--O 1.245 0.821 0 CA-C-O 118.454 -0.784 . . . . 3.21 110.03 179.119 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . 0.43 ' HB3' ' OD1' ' B' ' 290' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 109.488 -0.56 . . . . 3.11 109.488 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.497 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . . . -72.25 -24.8 61.42 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-O 121.232 0.539 . . . . 0.6 110.975 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . 0.639 ' HA ' ' CE ' ' A' ' 71' ' ' MET . . . -68.53 -0.55 5.21 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.219 0.822 . . . . 0.65 113.219 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . 0.511 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 2.9 m120 -114.38 -36.47 4.63 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 123.233 1.492 . . . . 0.87 109.745 176.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 6.4 mt -80.82 -3.06 49.76 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 113.018 -1.901 . . . . 1.37 111.156 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.704 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 3.1 m0 -100.04 -52.7 0.18 Allowed Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 107.449 -1.315 . . . . 0.42 107.449 174.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.59 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 11.6 Cg_exo -49.54 -39.05 45.75 Favored 'Trans proline' 0 C--N 1.376 1.978 0 C-N-CA 122.969 2.446 . . . . 0.54 111.545 175.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.461 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 3.1 t -60.83 -64.05 3.58 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 108.617 -0.883 . . . . 0.95 108.617 177.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.461 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 2.8 Cg_exo -47.3 -36.17 22.16 Favored 'Trans proline' 0 C--N 1.359 1.11 0 C-N-CA 122.599 2.2 . . . . 0.54 112.834 174.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 13.0 tp -70.85 -37.49 73.14 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 120.725 0.298 . . . . 0.56 110.528 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 14.6 ttt -65.08 -36.25 83.74 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.522 -0.918 . . . . 1.79 108.522 178.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 30.9 mm -66.07 -37.52 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-N 114.776 -1.102 . . . . 0.5 108.434 176.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . 0.528 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.2 OUTLIER -65.08 -40.99 95.44 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 108.684 -0.858 . . . . 0.51 108.684 177.355 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 16.9 mtp180 -61.91 -38.69 89.33 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.04 -0.726 . . . . 2.44 109.04 178.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 67.2 m -64.03 -45.21 89.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.562 -0.745 . . . . 0.66 110.339 178.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 15.6 tptp -68.56 -30.6 69.41 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.101 0.476 . . . . 2.44 109.863 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 6.1 tttp -68.2 -31.23 70.61 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.896 0.855 . . . . 0.82 108.796 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -77.41 -40.05 44.92 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.66 -1.155 . . . . 1.16 108.932 177.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 C--O 1.247 0.963 0 CA-C-N 115.61 -0.723 . . . . 1.39 111.025 178.836 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' ' CA' . . . . . 0.649 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' ' CA' . . . . . 0.647 'CA ' ' OD1' ' A' ' 56' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.993 0 N-CA-C 110.207 -0.294 . . . . 2.58 110.207 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -79.07 70.55 5.45 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.22 0.533 . . . . 3.47 111.405 -179.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -102.34 -55.06 2.54 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.876 -0.602 . . . . 2.95 109.48 179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 89.7 mt -97.75 76.94 2.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.53 -0.759 . . . . 1.97 110.303 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.0 p -75.66 -82.14 0.07 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.478 -0.783 . . . . 1.68 110.971 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 49.03 47.16 22.12 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.837 -0.62 . . . . 1.44 111.3 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.06 -55.0 2.57 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.014 -0.539 . . . . 1.35 109.955 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -94.9 -32.96 12.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.446 0.641 . . . . 1.61 109.528 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.416 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 4.5 mt -58.11 -26.96 30.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.277 -0.874 . . . . 1.23 111.037 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.37 -32.15 73.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.097 -0.501 . . . . 0.98 110.844 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -81.31 -27.97 34.79 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.27 -0.423 . . . . 1.18 110.734 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -72.38 -36.62 68.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.841 -0.618 . . . . 1.27 109.79 178.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 91.4 mttt -67.89 -26.4 65.98 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.824 -0.626 . . . . 0.99 110.227 179.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.508 ' HG2' ' HE3' ' B' ' 299' ' ' LYS . 4.9 tp10 -60.78 -33.63 73.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.54 -0.754 . . . . 1.29 109.939 178.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.01 -41.5 99.57 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.921 -0.581 . . . . 0.58 109.741 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -77.1 3.03 13.44 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.214 -0.448 . . . . 0.98 111.56 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 7.5 m -117.54 -36.98 3.56 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.194 -0.457 . . . . 0.73 111.486 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.457 HD12 ' HG2' ' B' ' 299' ' ' LYS . 89.1 mt -96.3 -20.09 18.78 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.102 0.408 . . . . 0.55 112.102 -179.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -85.86 -53.62 5.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.9 0.381 . . . . 0.79 110.216 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.66 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 23.6 t70 -83.06 142.58 31.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.481 -0.781 . . . . 0.59 111.631 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.8 mptt -127.77 -10.06 5.54 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.999 -0.546 . . . . 1.57 110.622 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.604 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 0.4 OUTLIER -78.81 -41.46 30.2 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 120.983 0.421 . . . . 0.82 110.198 -178.871 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 115.94 1.62 20.81 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 111.187 -0.765 . . . . 0.87 111.187 -178.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -72.47 -36.09 68.38 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.885 -0.413 . . . . 0.74 109.885 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.54 35.78 62.74 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.871 -0.68 . . . . 1.3 112.467 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.76 145.7 38.59 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 110.273 -0.269 . . . . 0.66 110.273 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 65.1 mt -87.91 111.29 21.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 C-N-CA 120.661 -0.416 . . . . 0.5 110.793 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.3 p -123.65 -177.5 3.75 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.777 -0.823 . . . . 0.77 108.777 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.612 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -57.75 -30.94 66.0 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.474 0.546 . . . . 0.59 112.474 179.015 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -64.32 -48.23 76.41 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.03 0.752 . . . . 0.56 113.03 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.651 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 51.1 mp0 -79.31 -22.52 44.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.449 0.642 . . . . 0.87 110.954 -177.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 35.8 tp -74.33 -35.97 63.64 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.2 -0.909 . . . . 0.47 110.742 -179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -88.26 -29.17 20.55 Favored Glycine 0 CA--C 1.518 0.246 0 C-N-CA 120.786 -0.721 . . . . 0.36 113.099 -179.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.407 ' OG1' ' HA ' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -60.78 -40.97 94.56 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.944 0.372 . . . . 0.47 111.541 -178.663 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.431 HG13 ' N ' ' A' ' 36' ' ' MET . 14.5 p -68.96 -48.29 71.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.523 -0.308 . . . . 1.38 110.403 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.431 ' N ' HG13 ' A' ' 35' ' ' VAL . 61.6 mtt -60.22 -42.27 94.81 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.675 -0.239 . . . . 0.85 111.267 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -35.07 74.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.306 -0.406 . . . . 1.95 110.769 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.7 m -91.09 0.35 57.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.259 -0.428 . . . . 0.59 111.367 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.3 tp -103.92 -57.89 1.96 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.782 0.325 . . . . 0.72 110.983 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -151.19 45.67 0.63 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.675 -0.774 . . . . 0.56 111.899 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 71.21 155.96 0.15 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.423 0.689 . . . . 2.83 110.984 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -106.6 138.0 19.63 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.25 -0.432 . . . . 0.96 110.853 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.38 -164.45 0.16 Allowed 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 122.572 2.181 . . . . 0.61 111.421 178.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.1 p -75.86 163.51 27.15 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.835 -0.346 . . . . 0.8 110.363 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -62.96 -30.45 71.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.045 -0.525 . . . . 2.13 110.963 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.87 -42.61 99.83 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.151 0.5 . . . . 0.7 110.667 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -71.56 -36.28 70.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.776 -0.647 . . . . 0.81 110.107 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.612 ' HG ' HG22 ' A' ' 29' ' ' THR . 59.6 tp -64.14 -45.76 87.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.619 -0.718 . . . . 0.76 110.381 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -69.11 -32.13 71.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.952 0.405 . . . . 1.12 110.829 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -69.71 -38.98 77.13 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.302 -0.408 . . . . 1.42 110.155 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.448 ' O ' HG12 ' A' ' 55' ' ' VAL . 4.9 mmm -57.5 -46.35 83.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.72 -0.673 . . . . 0.54 112.125 -179.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.404 ' HA ' ' CG1' ' A' ' 55' ' ' VAL . 8.8 tp -69.16 -22.44 26.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 120.603 -0.439 . . . . 0.59 111.263 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -22.83 51.83 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.212 0.53 . . . . 1.06 109.6 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.603 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 7.3 tt0 -82.36 -18.73 41.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.678 -0.692 . . . . 1.58 110.665 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.784 HG21 ' CZ2' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -103.72 -48.33 10.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.153 0.427 . . . . 0.82 112.153 -179.71 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.645 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 20.0 t70 -83.35 106.01 14.77 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.274 0.559 . . . . 0.7 110.932 -179.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.2 -20.4 28.6 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.503 -0.771 . . . . 0.9 112.057 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.34 -29.43 69.62 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 110.037 -0.357 . . . . 0.85 110.037 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 91.41 34.15 7.63 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.77 -0.729 . . . . 1.03 114.11 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -129.65 -5.96 4.64 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 122.512 -0.405 . . . . 1.61 110.187 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.11 13.57 64.73 Favored Glycine 0 C--N 1.336 0.57 0 C-N-CA 121.282 -0.485 . . . . 0.67 112.954 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 3.9 m -119.04 130.07 55.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.751 0.31 . . . . 0.65 110.51 -179.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.631 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.4 OUTLIER -121.21 120.0 60.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.962 -0.563 . . . . 0.5 110.685 178.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -99.2 -172.91 2.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.164 -0.925 . . . . 1.09 109.955 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.528 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 4.3 m-85 -54.07 -54.97 41.39 Favored Pre-proline 0 N--CA 1.466 0.366 0 C-N-CA 122.549 0.339 . . . . 1.78 111.593 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.8 Cg_endo -52.13 -42.13 61.06 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 122.684 2.256 . . . . 0.79 112.775 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.653 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 34.8 mt-10 -69.0 -48.08 63.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.66 110.373 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -58.58 -47.42 84.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.511 -0.768 . . . . 0.77 111.75 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 70.2 mt -59.3 -26.75 65.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.209 -0.45 . . . . 0.9 111.811 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.5 m -93.55 -36.42 12.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.523 -0.308 . . . . 1.02 110.995 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.427 ' CE ' ' HA ' ' B' ' 289' ' ' ALA . 6.5 tpt -62.63 -47.94 81.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.69 111.47 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.26 2.88 6.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.102 -0.499 . . . . 0.99 111.3 -179.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -119.8 11.88 11.99 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.212 0.53 . . . . 1.21 110.364 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.2 mmm180 -113.72 75.49 0.93 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.8 -0.636 . . . . 2.56 110.858 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.66 120.57 42.0 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.068 -0.514 . . . . 3.25 110.2 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 4.4 mpp? -61.16 158.02 14.8 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.628 -0.715 . . . . 2.59 109.751 178.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -77.51 66.44 3.24 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.149 0.5 . . . . 2.45 110.683 -179.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -132.51 144.03 50.16 Favored 'General case' 0 CA--C 1.506 -0.73 0 CA-C-N 115.566 -0.743 . . . . 2.35 110.106 -178.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.5 m -74.41 105.82 5.74 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.933 -0.576 . . . . 3.14 110.107 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.391 -0.814 . . . . 3.21 110.51 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . 0.603 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 1.5 ttm180 . . . . . 0 N--CA 1.479 1.005 0 N-CA-C 109.833 -0.432 . . . . 3.11 109.833 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . . . . . . . . . . . -57.95 -30.57 66.08 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 113.148 0.796 . . . . 0.6 113.148 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . 0.699 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -67.67 -15.27 63.56 Favored 'General case' 0 C--O 1.201 -1.478 0 CA-C-O 118.728 -0.653 . . . . 0.65 109.838 -178.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -98.45 -40.34 8.32 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 118.477 0.58 . . . . 0.87 110.884 174.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 9.0 mp -75.2 -9.91 58.98 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 115.545 -0.752 . . . . 1.37 111.263 -179.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.784 ' CZ2' HG21 ' A' ' 55' ' ' VAL . 2.2 m95 -88.92 -54.59 0.32 Allowed Pre-proline 0 C--N 1.321 -0.638 0 N-CA-C 107.601 -1.259 . . . . 0.42 107.601 175.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.699 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 6.6 Cg_exo -48.02 -36.76 28.6 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 123.653 2.902 . . . . 0.54 113.141 174.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.529 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 12.5 t -59.39 -62.03 6.67 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 119.126 -0.464 . . . . 0.95 111.332 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.529 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 92.7 Cg_exo -51.33 -35.87 55.48 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 122.016 1.811 . . . . 0.54 112.178 176.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 46.3 tp -66.95 -38.44 86.12 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.719 -0.474 . . . . 0.56 109.719 178.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 27.5 ttt -63.53 -37.07 85.91 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.52 -0.919 . . . . 1.79 108.52 177.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 44.0 mm -64.33 -38.99 83.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 108.379 -0.971 . . . . 0.5 108.379 177.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . 0.508 ' HE3' ' HG2' ' A' ' 14' ' ' GLU . 0.1 OUTLIER -62.16 -44.17 97.21 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.866 -0.606 . . . . 0.51 109.474 178.087 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -62.83 -38.2 89.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.743 -0.662 . . . . 2.44 109.769 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 22.7 m -67.75 -33.89 75.74 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.929 -0.578 . . . . 0.66 109.833 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -77.27 -29.68 54.01 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.14 -0.689 . . . . 2.44 109.14 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . 0.498 ' HG3' ' HG2' ' A' ' 14' ' ' GLU . 0.9 OUTLIER -70.51 -33.73 71.53 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 108.404 -0.962 . . . . 0.82 108.404 178.893 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -77.62 -40.54 41.61 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.34 -0.985 . . . . 1.16 108.34 177.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 3.5 m . . . . . 0 C--O 1.251 1.172 0 CA-C-N 115.768 -0.651 . . . . 1.39 111.221 177.858 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' ' CA' . . . . . 0.66 'CA ' ' OD1' ' A' ' 20' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' ' CA' . . . . . 0.653 'CA ' ' OE1' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.406 ' HB3' ' OE1' ' A' ' 3' ' ' GLN . . . . . . . . 0 N--CA 1.475 0.824 0 N-CA-C 109.88 -0.415 . . . . 2.58 109.88 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -77.79 -11.27 59.87 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.182 0.438 . . . . 3.47 112.182 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.406 ' OE1' ' HB3' ' A' ' 1' ' ' ALA . 0.0 OUTLIER -78.81 -59.76 2.65 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 121.943 -0.473 . . . . 2.95 111.216 -179.797 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.4 mt -86.18 79.0 9.25 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.077 0.465 . . . . 1.97 110.08 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.9 p -87.32 -72.8 0.5 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.36 -0.837 . . . . 1.68 110.778 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 52.21 56.4 7.79 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.631 -0.713 . . . . 1.44 111.275 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.39 -94.68 0.46 Allowed 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.468 -0.568 . . . . 1.35 109.468 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -60.02 -31.02 69.55 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.737 0.303 . . . . 1.61 110.19 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.413 ' HA ' ' CD2' ' A' ' 12' ' ' PHE . 14.8 mt -59.76 -35.73 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-O 121.004 0.43 . . . . 1.23 111.055 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.79 -31.3 69.14 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.43 0.634 . . . . 0.98 110.695 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -73.72 -21.63 60.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.538 0.685 . . . . 1.18 109.781 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.413 ' CD2' ' HA ' ' A' ' 9' ' ' ILE . 20.1 m-85 -76.36 -35.06 58.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.319 -0.855 . . . . 1.27 109.758 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.604 ' HA ' ' CD2' ' A' ' 16' ' ' PHE . 81.6 mttt -66.21 -28.85 69.06 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.498 0.666 . . . . 0.99 109.427 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.402 ' HB3' ' HZ2' ' B' ' 299' ' ' LYS . 3.8 tp10 -60.0 -36.81 78.0 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.775 -1.102 . . . . 1.29 110.851 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.471 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -64.49 -39.19 93.33 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.939 -0.573 . . . . 0.58 111.011 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.604 ' CD2' ' HA ' ' A' ' 13' ' ' LYS . 9.7 m-85 -65.75 -14.0 60.46 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.704 0.288 . . . . 0.98 111.444 -179.282 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 42.5 m -110.71 -36.03 5.83 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.382 0.512 . . . . 0.73 112.382 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.0 mt -91.93 -22.93 19.77 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.337 0.495 . . . . 0.55 112.337 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.471 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 84.8 t80 -91.55 -50.01 6.0 Favored 'General case' 0 C--N 1.327 -0.38 0 O-C-N 122.353 -0.217 . . . . 0.79 110.622 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.638 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 24.1 t70 -80.46 148.52 30.45 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.384 -0.371 . . . . 0.59 111.099 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -130.61 15.04 5.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.32 -0.4 . . . . 1.57 111.361 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -108.94 -38.34 5.61 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.063 0.459 . . . . 0.82 110.525 -178.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 122.64 -13.15 8.75 Favored Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 111.109 -0.797 . . . . 0.87 111.109 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -69.1 -39.52 78.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.424 -0.388 . . . . 0.74 110.986 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 75.18 24.96 69.88 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.873 -0.68 . . . . 1.3 112.903 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.703 HG22 ' HA ' ' A' ' 64' ' ' ASP . 22.5 p -119.7 156.26 30.83 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.935 0.368 . . . . 0.66 110.727 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.594 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 55.7 mt -96.14 108.35 21.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.027 0.441 . . . . 0.5 111.36 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.68 175.9 6.0 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.425 -0.807 . . . . 0.77 109.592 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.474 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -53.43 -41.81 66.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.234 0.54 . . . . 0.59 111.892 179.916 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -58.03 -53.3 59.76 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.343 -0.844 . . . . 0.56 113.269 -178.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.653 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 18.4 mp0 -75.73 -23.49 56.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.679 0.276 . . . . 0.87 111.716 -177.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.427 HD11 ' CD1' ' B' ' 292' ' ' TRP . 14.4 tp -69.93 -49.98 46.6 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.05 -0.523 . . . . 0.47 109.966 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.585 ' O ' ' HB2' ' A' ' 37' ' ' ARG . . . -71.68 -36.91 61.83 Favored Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 115.47 -0.786 . . . . 0.36 113.634 -178.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.62 -41.23 89.94 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 117.825 0.813 . . . . 0.47 112.232 -178.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.405 HG11 ' HB3' ' B' ' 295' ' ' PRO . 72.7 t -71.93 -57.02 8.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.666 0.27 . . . . 1.38 110.918 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 36.3 mtt -58.43 -27.56 64.44 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.396 -0.365 . . . . 0.85 111.517 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.585 ' HB2' ' O ' ' A' ' 33' ' ' GLY . 43.6 ttt180 -62.97 -32.69 74.07 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.986 -0.552 . . . . 1.95 111.158 178.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.5 m -94.3 -3.98 49.54 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.955 -0.566 . . . . 0.59 111.373 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.4 tp -95.33 -42.35 8.56 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.251 -0.431 . . . . 0.72 110.858 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 41' ' ' GLN . . . -163.31 38.35 0.33 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.699 -0.763 . . . . 0.56 112.163 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 40' ' ' GLY . 1.2 mp0 71.79 154.01 0.13 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.449 0.642 . . . . 2.83 111.644 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -119.28 139.24 27.32 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.034 -0.53 . . . . 0.96 110.117 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -77.12 -157.76 0.07 OUTLIER 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.312 2.008 . . . . 0.61 113.045 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.0 p -77.73 160.85 28.15 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 122.045 -0.409 . . . . 0.8 111.911 -178.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -54.71 -31.53 58.28 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.744 -0.662 . . . . 2.13 110.865 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.4 -54.22 40.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 0.7 110.597 179.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -64.19 -34.02 77.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.746 -0.661 . . . . 0.81 110.515 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.474 ' HG ' HG22 ' A' ' 29' ' ' THR . 46.6 tp -67.71 -41.61 83.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.671 -0.695 . . . . 0.76 110.747 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.498 ' O ' HG22 ' A' ' 52' ' ' ILE . 23.0 tt0 -67.35 -32.23 73.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.169 -0.469 . . . . 1.12 110.144 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -66.87 -32.36 73.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.203 0.525 . . . . 1.42 109.922 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.4 mmm -64.61 -38.78 92.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.425 -0.807 . . . . 0.54 111.276 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.498 HG22 ' O ' ' A' ' 49' ' ' GLN . 6.9 tp -75.89 -12.64 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.152 0.501 . . . . 0.59 110.914 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -85.44 -21.75 28.6 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.932 -0.766 . . . . 1.06 108.932 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.674 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 11.4 tt0 -89.76 16.8 7.37 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.384 -1.28 . . . . 1.58 110.572 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.712 ' HB ' ' HB3' ' B' ' 288' ' ' ALA . 6.6 p -146.82 -38.6 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 120.094 -0.642 . . . . 0.82 112.557 -177.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.632 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 20.7 t70 -85.79 98.49 10.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.319 0.58 . . . . 0.7 109.716 178.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.4 -19.77 29.21 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 113.018 0.747 . . . . 0.9 113.018 -177.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -71.4 -36.62 71.44 Favored 'General case' 0 C--N 1.327 -0.39 0 O-C-N 122.444 -0.16 . . . . 0.85 110.821 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 101.25 49.0 1.37 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.204 -0.998 . . . . 1.03 113.839 178.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 27.0 p-10 -135.31 -14.53 1.98 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 117.111 0.456 . . . . 1.61 110.531 178.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 72.69 24.84 75.41 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 121.087 -0.577 . . . . 0.67 112.63 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 18.4 m -155.35 126.72 7.26 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.78 -0.452 . . . . 0.65 109.78 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.485 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.6 OUTLIER -100.47 108.85 23.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 120.456 -0.498 . . . . 0.5 110.479 179.829 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.703 ' HA ' HG22 ' A' ' 26' ' ' THR . 28.5 t0 -83.17 175.04 10.26 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.097 -0.956 . . . . 1.09 110.052 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.448 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 4.5 m-85 -46.17 -53.69 21.25 Favored Pre-proline 0 CA--C 1.544 0.725 0 N-CA-C 112.915 0.709 . . . . 1.78 112.915 -178.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.448 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 19.7 Cg_endo -59.14 -38.56 85.84 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 122.138 1.892 . . . . 0.79 112.866 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.634 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 27.0 mt-10 -66.53 -40.38 89.1 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.187 0.518 . . . . 0.66 110.257 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -63.38 -36.33 83.35 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.45 -0.795 . . . . 0.77 110.903 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.5 mt -62.34 -23.37 66.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.181 -0.463 . . . . 0.9 111.693 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.11 -40.42 9.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.192 0.52 . . . . 1.02 110.508 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.573 ' HE3' ' HA ' ' B' ' 289' ' ' ALA . 10.9 tpt -54.84 -48.83 72.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.264 -0.88 . . . . 0.69 111.803 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.429 ' SD ' ' HG3' ' A' ' 71' ' ' MET . 0.1 OUTLIER -89.8 22.93 2.9 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 122.241 -0.287 . . . . 0.99 111.77 -179.442 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.09 -41.81 1.11 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.298 0.571 . . . . 1.21 111.454 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -86.48 84.18 7.48 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.016 -0.538 . . . . 2.56 110.829 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.7 pttt -93.22 161.86 14.24 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.69 -0.485 . . . . 3.25 109.69 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.9 tpp -86.91 143.43 27.41 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.724 0.297 . . . . 2.59 110.777 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -79.03 65.88 4.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.268 0.556 . . . . 2.45 110.974 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -111.96 174.22 5.98 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.912 -0.585 . . . . 2.35 109.866 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.69 45.57 1.3 Allowed 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.533 0.683 . . . . 3.14 110.577 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 . . . . . 0 C--O 1.251 1.149 0 CA-C-N 115.107 -0.952 . . . . 3.21 110.391 -179.932 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . 0.674 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 1.4 tpm_? . . . . . 0 N--CA 1.479 0.978 0 N-CA-C 110.564 -0.162 . . . . 3.11 110.564 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.712 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -58.44 -30.91 67.28 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 120.801 0.334 . . . . 0.6 111.39 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . 0.717 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -70.44 -12.21 61.42 Favored 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 116.05 -0.523 . . . . 0.65 111.316 -178.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . 0.448 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 14.8 m120 -99.87 -40.86 7.48 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-O 121.76 0.791 . . . . 0.87 110.033 173.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . 0.585 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 5.7 mt -66.38 -44.54 82.85 Favored 'General case' 0 C--O 1.206 -1.211 0 CA-C-N 114.77 -1.105 . . . . 1.37 109.42 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.681 ' CE2' HG21 ' A' ' 55' ' ' VAL . 10.3 m0 -56.29 -53.92 58.56 Favored Pre-proline 0 N--CA 1.467 0.411 0 N-CA-C 109.519 -0.549 . . . . 0.42 109.519 177.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.717 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 13.1 Cg_exo -47.79 -31.56 15.24 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 122.673 2.248 . . . . 0.54 112.951 175.205 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.571 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 6.0 m -58.05 -65.0 2.11 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-O 118.459 -0.781 . . . . 0.95 110.847 178.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.585 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 86.9 Cg_exo -52.56 -33.75 59.65 Favored 'Trans proline' 0 C--N 1.369 1.65 0 C-N-CA 121.62 1.547 . . . . 0.54 112.884 176.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 10.7 tp -67.09 -38.79 86.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.234 0.54 . . . . 0.56 109.609 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 24.8 ttt -67.47 -38.93 85.15 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.715 -0.846 . . . . 1.79 108.715 178.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . 0.482 HG12 ' O ' ' B' ' 294' ' ' SER . 18.3 mm -66.91 -36.2 76.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.021 -0.991 . . . . 0.5 108.689 177.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . 0.402 ' HZ2' ' HB3' ' A' ' 14' ' ' GLU . 0.1 OUTLIER -63.75 -35.75 81.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.698 -0.683 . . . . 0.51 109.419 178.199 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 2.4 mmt180 -68.12 -38.4 82.18 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.855 -0.611 . . . . 2.44 109.583 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 28.6 m -69.62 -33.74 73.09 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.54 -0.754 . . . . 0.66 110.401 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -77.11 -32.83 56.83 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.292 -0.632 . . . . 2.44 109.292 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.5 -33.2 74.61 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.705 -0.68 . . . . 0.82 109.202 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -77.88 -35.96 50.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.254 -0.885 . . . . 1.16 109.941 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.5 t . . . . . 0 C--O 1.252 1.201 0 CA-C-O 118.108 -0.949 . . . . 1.39 110.301 179.662 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' ' CA' . . . . . 0.653 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' ' CA' . . . . . 0.634 'CA ' ' OE1' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 110.003 -0.369 . . . . 2.58 110.003 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -82.78 62.1 6.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.287 0.565 . . . . 3.47 111.091 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.28 -39.02 25.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.722 -0.672 . . . . 2.95 110.227 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.1 mt -84.47 60.71 6.2 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.021 -0.536 . . . . 1.97 110.909 -179.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.27 -79.52 0.16 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.515 -0.766 . . . . 1.68 110.772 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.46 ' CD ' ' HZ1' ' A' ' 13' ' ' LYS . 2.2 mm-40 49.26 61.34 3.19 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.977 -0.556 . . . . 1.44 111.213 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.14 -44.68 1.15 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.676 -0.693 . . . . 1.35 109.631 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -87.24 -37.55 17.14 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.69 -0.856 . . . . 1.61 108.69 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.446 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 2.8 mt -58.97 -31.86 46.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.149 -0.932 . . . . 1.23 111.143 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.26 -37.81 88.69 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.371 -0.603 . . . . 0.98 109.371 178.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -71.76 -32.31 67.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.308 -0.86 . . . . 1.18 110.315 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.1 m-30 -70.93 -37.27 72.88 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.068 -0.514 . . . . 1.27 110.45 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.46 ' HZ1' ' CD ' ' A' ' 6' ' ' GLU . 82.6 mttt -64.71 -32.99 74.92 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 121.61 0.719 . . . . 0.99 110.046 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.487 ' HA ' ' OE1' ' A' ' 14' ' ' GLU . 1.4 tp10 -59.64 -32.28 70.29 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.459 -0.791 . . . . 1.29 110.639 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.31 -45.76 86.53 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.147 -0.479 . . . . 0.58 110.738 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -82.1 12.23 4.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.799 0.333 . . . . 0.98 111.808 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.8 m -123.05 -44.27 2.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.365 -0.38 . . . . 0.73 111.019 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.48 ' HB2' ' CG ' ' B' ' 299' ' ' LYS . 92.4 mt -88.98 -31.85 17.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.826 0.346 . . . . 0.55 111.456 -179.329 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -77.54 -56.34 4.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.882 0.372 . . . . 0.79 110.43 -179.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.638 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 19.8 t70 -86.02 140.17 30.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.812 -0.631 . . . . 0.59 110.751 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.3 mptt -119.22 -0.17 11.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.923 -0.581 . . . . 1.57 111.305 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.635 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 9.7 m-20 -86.95 -45.07 11.14 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.087 0.47 . . . . 0.82 110.031 -179.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 119.26 -6.66 12.9 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 110.586 -1.006 . . . . 0.87 110.586 -178.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -61.52 -33.52 73.96 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 114.642 -0.779 . . . . 0.74 109.966 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.66 41.97 97.49 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.008 -0.615 . . . . 1.3 112.77 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -141.9 145.85 35.07 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.811 -0.194 . . . . 0.66 110.517 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.491 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 89.9 mt -84.68 106.47 14.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.076 0.465 . . . . 0.5 110.355 178.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.09 178.11 4.75 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.869 -0.605 . . . . 0.77 109.651 179.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.52 -35.22 67.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.01 0.433 . . . . 0.59 111.086 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -58.91 -49.08 79.15 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.943 -0.571 . . . . 0.56 112.168 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.653 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 54.8 mp0 -81.01 -26.01 36.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.257 0.551 . . . . 0.87 111.335 -178.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.459 HD21 ' CE ' ' A' ' 51' ' ' MET . 20.1 tp -72.35 -32.85 66.83 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.387 -0.824 . . . . 0.47 110.213 -179.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -86.74 -33.37 13.06 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.87 -0.681 . . . . 0.36 113.825 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.88 -40.03 79.28 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 112.41 0.522 . . . . 0.47 112.41 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.5 p -70.51 -50.71 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 O-C-N 122.17 -0.331 . . . . 1.38 110.636 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.0 mtt -56.26 -43.74 79.04 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.065 0.46 . . . . 0.85 111.264 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -53.99 -42.01 68.56 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.373 -0.83 . . . . 1.95 111.872 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.8 m -84.17 -18.72 35.74 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.071 -0.513 . . . . 0.59 111.77 -178.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.6 mp -87.85 -53.16 4.9 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 111.894 0.331 . . . . 0.72 111.894 -178.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -150.55 43.19 0.73 Allowed Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.471 -0.871 . . . . 0.56 112.154 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 71.32 155.45 0.15 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.604 0.716 . . . . 2.83 111.344 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -95.61 134.19 24.57 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.728 -0.669 . . . . 0.96 109.91 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.25 -160.46 0.11 Allowed 'Trans proline' 0 C--O 1.23 0.116 0 C-N-CA 122.824 2.35 . . . . 0.61 111.301 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.1 p -83.63 165.17 19.21 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 109.689 -0.486 . . . . 0.8 109.689 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -64.91 -24.13 67.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 2.13 110.199 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.24 -50.87 62.29 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.313 -0.403 . . . . 0.7 110.859 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -68.11 -33.72 75.05 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.317 0.58 . . . . 0.81 110.199 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.5 tp -68.3 -41.36 81.04 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.732 -0.667 . . . . 0.76 111.424 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.481 ' O ' HG22 ' A' ' 52' ' ' ILE . 23.4 tt0 -67.64 -40.78 84.56 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.876 -0.602 . . . . 1.12 110.792 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -72.6 -27.07 61.94 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.576 -0.45 . . . . 1.42 110.706 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.463 ' O ' HG12 ' A' ' 55' ' ' VAL . 1.1 tmm? -62.91 -38.58 91.53 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.494 -0.321 . . . . 0.54 110.48 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.481 HG22 ' O ' ' A' ' 49' ' ' GLN . 10.3 tp -78.76 -15.82 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 CA-C-O 121.368 0.604 . . . . 0.59 110.062 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -83.98 -27.88 28.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.827 0.822 . . . . 1.06 108.872 178.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.438 ' CD ' ' HG3' ' B' ' 287' ' ' ARG . 0.9 OUTLIER -81.54 14.79 2.36 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.977 -1.01 . . . . 1.58 111.0 -179.629 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.685 HG21 ' CE2' ' B' ' 292' ' ' TRP . 1.4 p -144.24 -41.16 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 116.477 -0.328 . . . . 0.82 111.253 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.642 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 21.5 t70 -77.94 92.19 4.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.653 0.739 . . . . 0.7 110.827 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.53 -29.29 68.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.082 -0.963 . . . . 0.9 112.283 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.96 -39.71 87.32 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 121.053 -0.259 . . . . 0.85 110.484 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 95.12 46.99 2.71 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.953 -0.642 . . . . 1.03 113.249 178.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -137.47 -0.76 2.15 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.432 0.634 . . . . 1.61 110.233 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.89 15.5 69.26 Favored Glycine 0 C--N 1.334 0.459 0 CA-C-N 115.57 -0.741 . . . . 0.67 113.191 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.8 m -134.05 133.82 41.63 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 121.377 0.608 . . . . 0.65 111.373 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.641 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.3 OUTLIER -121.19 118.6 56.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.966 -0.561 . . . . 0.5 109.763 178.974 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -99.06 -172.59 2.31 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 123.743 0.652 . . . . 1.09 109.749 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.484 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 0.4 OUTLIER -51.75 -55.32 31.01 Favored Pre-proline 0 N--CA 1.469 0.494 0 CA-C-O 119.088 -0.482 . . . . 1.78 112.121 -179.659 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 6.0 Cg_endo -49.07 -44.61 32.31 Favored 'Trans proline' 0 C--N 1.354 0.816 0 C-N-CA 122.456 2.104 . . . . 0.79 112.48 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.642 ' OE2' 'CA ' ' A' ' 182' ' ' ' CA' . 21.4 mt-10 -69.34 -47.16 65.2 Favored 'General case' 0 C--O 1.222 -0.348 0 O-C-N 123.881 0.738 . . . . 0.66 110.51 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -59.03 -40.48 85.16 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.049 0.452 . . . . 0.77 111.462 -178.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 97.7 mt -57.23 -35.06 69.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.629 -0.714 . . . . 0.9 111.272 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -87.24 -37.82 16.9 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.279 -0.419 . . . . 1.02 110.903 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.583 ' HE3' ' HA ' ' B' ' 289' ' ' ALA . 11.1 tpt -59.1 -46.97 86.95 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.905 -0.589 . . . . 0.69 111.639 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.69 29.43 1.16 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.666 -0.243 . . . . 0.99 111.267 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -136.46 -49.63 0.66 Allowed 'General case' 0 C--O 1.237 0.415 0 CA-C-O 120.842 0.353 . . . . 1.21 110.357 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.42 90.11 3.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.064 -0.516 . . . . 2.56 109.842 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -99.86 158.05 16.08 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.171 -0.468 . . . . 3.25 110.592 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -81.15 162.63 23.57 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.264 -0.425 . . . . 2.59 110.855 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.7 mttm -98.21 -6.39 31.36 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.192 -0.458 . . . . 2.45 111.922 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -82.82 -175.54 5.85 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.608 -0.515 . . . . 2.35 109.608 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.7 m -95.0 130.15 41.78 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.654 -0.248 . . . . 3.14 110.478 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.456 ' HB2' ' ND2' ' B' ' 290' ' ' ASN . 1.4 p-10 . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.02 -0.99 . . . . 3.21 110.221 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . 0.438 ' HG3' ' CD ' ' A' ' 54' ' ' GLU . 8.4 ttt-85 . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 109.353 -0.61 . . . . 3.11 109.353 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.539 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -59.88 -23.77 63.72 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.049 0.452 . . . . 0.6 111.559 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . 0.693 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -67.43 -11.81 58.71 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-O 119.02 -0.514 . . . . 0.65 109.655 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . 0.456 ' ND2' ' HB2' ' A' ' 80' ' ' ASP . 5.7 m120 -99.9 -35.32 9.79 Favored 'General case' 0 C--O 1.246 0.915 0 CA-C-O 121.473 0.654 . . . . 0.87 111.086 174.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . 0.495 ' O ' ' HG2' ' B' ' 295' ' ' PRO . 7.1 mp -79.73 -8.08 59.02 Favored 'General case' 0 C--O 1.213 -0.868 0 C-N-CA 123.878 0.871 . . . . 1.37 110.416 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.685 ' CE2' HG21 ' A' ' 55' ' ' VAL . 6.1 m0 -92.45 -55.1 0.25 Allowed Pre-proline 0 C--N 1.318 -0.792 0 N-CA-C 108.062 -1.088 . . . . 0.42 108.062 174.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.693 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 9.8 Cg_exo -48.51 -38.63 35.92 Favored 'Trans proline' 0 C--N 1.36 1.133 0 C-N-CA 123.337 2.691 . . . . 0.54 112.707 175.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.497 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 5.6 t -61.53 -62.58 5.62 Favored Pre-proline 0 CA--C 1.546 0.817 0 N-CA-C 108.616 -0.883 . . . . 0.95 108.616 178.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.497 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 1.0 OUTLIER -46.25 -40.18 21.67 Favored 'Trans proline' 0 C--N 1.361 1.192 0 C-N-CA 123.156 2.571 . . . . 0.54 113.343 174.745 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 13.5 tp -68.86 -37.39 79.07 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.049 0.452 . . . . 0.56 109.968 178.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 27.2 ttt -63.61 -37.6 87.95 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.614 -0.884 . . . . 1.79 108.614 178.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 34.3 mm -62.75 -41.21 91.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.113 -0.949 . . . . 0.5 109.073 177.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . 0.48 ' CG ' ' HB2' ' A' ' 18' ' ' LEU . 0.2 OUTLIER -62.45 -43.75 98.06 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.452 -0.795 . . . . 0.51 109.753 179.182 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -64.06 -33.98 76.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.295 0.569 . . . . 2.44 110.419 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 39.5 m -69.98 -34.72 73.73 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.621 -0.718 . . . . 0.66 109.245 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -75.98 -28.61 57.93 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 109.423 -0.584 . . . . 2.44 109.423 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -69.97 -35.42 74.45 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.691 -0.855 . . . . 0.82 108.691 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -76.14 -40.02 53.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.189 -0.914 . . . . 1.16 109.104 178.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 6.9 m . . . . . 0 C--O 1.247 0.935 0 CA-C-N 114.848 -1.069 . . . . 1.39 111.763 178.692 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' ' CA' . . . . . 0.653 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' ' CA' . . . . . 0.642 'CA ' ' OD1' ' A' ' 56' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.802 0 CA-C-O 120.897 0.38 . . . . 2.58 110.179 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -73.09 90.74 1.55 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.383 0.611 . . . . 3.47 110.23 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -147.58 -51.57 0.19 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.43 -0.804 . . . . 2.95 109.091 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 33.2 mt -96.39 37.54 1.26 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.369 -0.832 . . . . 1.97 109.853 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -68.23 0.54 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.556 -0.747 . . . . 1.68 110.906 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 43.65 67.66 0.63 Allowed 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.137 0.898 . . . . 1.44 111.593 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.83 -44.5 2.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 1.35 111.484 -179.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -89.55 -34.05 16.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.075 0.464 . . . . 1.61 110.391 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 26.7 mt -62.57 -25.5 38.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.81 -0.632 . . . . 1.23 110.018 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.427 ' HA ' ' HE3' ' A' ' 13' ' ' LYS . . . -63.13 -38.63 91.94 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.395 0.617 . . . . 0.98 111.103 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -83.72 -18.36 38.16 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.904 -0.589 . . . . 1.18 110.518 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 18.6 m-30 -75.94 -40.31 54.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.698 -0.683 . . . . 1.27 109.3 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.427 ' HE3' ' HA ' ' A' ' 10' ' ' ALA . 45.5 mtmt -64.79 -26.48 68.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.211 -0.904 . . . . 0.99 109.969 178.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.433 ' HG2' ' HE3' ' B' ' 299' ' ' LYS . 1.8 tp10 -67.37 -23.85 65.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.456 -0.793 . . . . 1.29 110.171 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.654 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -74.35 -37.54 63.49 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 109.793 -0.447 . . . . 0.58 109.793 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -75.26 -2.02 26.14 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.557 -0.457 . . . . 0.98 110.512 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -112.6 -53.56 2.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.965 0.412 . . . . 0.73 111.474 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.445 HD12 ' HG2' ' B' ' 299' ' ' LYS . 74.1 mt -85.76 -42.34 14.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.243 -0.435 . . . . 0.55 111.7 -179.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.654 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 82.6 t80 -75.06 -35.31 61.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.304 -0.407 . . . . 0.79 111.259 -177.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.635 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 39.0 t70 -91.96 130.58 37.68 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.844 -0.428 . . . . 0.59 109.844 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.472 ' HZ1' HG23 ' A' ' 35' ' ' VAL . 6.1 mptt -106.14 -9.65 16.84 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.439 0.533 . . . . 1.57 112.439 -178.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.643 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 0.0 OUTLIER -91.67 -35.56 14.13 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 111.688 0.255 . . . . 0.82 111.688 -178.076 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.06 0.76 33.75 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 121.184 -0.531 . . . . 0.87 111.815 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -81.33 -27.98 34.73 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.812 0.339 . . . . 0.74 110.576 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.06 -46.07 3.59 Favored Glycine 0 CA--C 1.518 0.249 0 C-N-CA 121.318 -0.468 . . . . 1.3 113.475 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -53.27 123.72 12.65 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.522 0.564 . . . . 0.66 112.522 -179.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.575 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 18.0 mt -69.83 119.28 15.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-N 116.254 -0.43 . . . . 0.5 111.32 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.26 168.66 14.44 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 108.9 -0.778 . . . . 0.77 108.9 178.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.78 -33.78 64.68 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.817 0.341 . . . . 0.59 111.709 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -60.47 -45.44 93.72 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.353 0.501 . . . . 0.56 112.353 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.662 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 19.4 mp0 -80.37 -23.21 40.62 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-O 121.216 0.531 . . . . 0.87 111.688 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.0 tp -72.06 -50.74 25.86 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.851 -0.613 . . . . 0.47 110.167 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.09 -36.13 79.8 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.787 -0.642 . . . . 0.36 113.939 -179.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -55.7 -32.71 63.54 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 117.677 0.738 . . . . 0.47 112.385 -178.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.472 HG23 ' HZ1' ' A' ' 21' ' ' LYS . 99.0 t -77.53 -51.61 17.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.233 -0.587 . . . . 1.38 109.955 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 52.6 mtt -59.0 -32.81 70.02 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.924 -0.58 . . . . 0.85 111.841 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.1 ttt180 -58.43 -40.45 82.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.45 -0.341 . . . . 1.95 111.789 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.1 m -97.29 -6.65 33.92 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.112 0.482 . . . . 0.59 110.645 -178.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 16.2 tp -87.06 -47.74 8.67 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.911 -0.586 . . . . 0.72 110.167 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -161.48 47.47 0.37 Allowed Glycine 0 C--N 1.335 0.479 0 C-N-CA 120.45 -0.881 . . . . 0.56 112.634 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 69.98 140.23 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.508 0.671 . . . . 2.83 111.476 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -99.36 136.51 20.4 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.029 -0.532 . . . . 0.96 110.587 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.61 -163.74 0.22 Allowed 'Trans proline' 0 C--O 1.24 0.575 0 C-N-CA 122.898 2.398 . . . . 0.61 112.063 179.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 73.0 p -73.64 163.9 27.38 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.355 -0.609 . . . . 0.8 109.355 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -68.18 -29.13 67.92 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.914 0.387 . . . . 2.13 110.181 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.37 -49.76 72.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.946 -0.57 . . . . 0.7 110.422 178.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -63.54 -35.42 80.44 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.909 -0.587 . . . . 0.81 110.644 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.0 tp -70.07 -34.55 73.33 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.949 -0.569 . . . . 0.76 110.182 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.506 ' O ' HG22 ' A' ' 52' ' ' ILE . 15.8 tt0 -68.11 -39.91 82.67 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.545 -0.539 . . . . 1.12 109.545 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -61.02 -29.84 69.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.557 0.694 . . . . 1.42 109.722 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.0 mmm -65.43 -43.27 90.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.353 -0.84 . . . . 0.54 111.946 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.506 HG22 ' O ' ' A' ' 49' ' ' GLN . 4.8 tp -71.73 -18.33 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 CA-C-O 120.985 0.422 . . . . 0.59 111.355 -178.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -81.06 -25.02 37.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.625 0.726 . . . . 1.06 110.577 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.413 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 13.1 tt0 -93.51 8.26 41.35 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.325 -0.852 . . . . 1.58 111.046 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.795 ' HB ' ' HB3' ' B' ' 288' ' ' ALA . 8.5 p -142.85 25.86 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.806 0.812 . . . . 0.82 112.701 -177.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.635 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 30.5 t70 -146.65 95.53 2.61 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.683 0.754 . . . . 0.7 109.709 178.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.24 -29.98 70.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.334 -0.848 . . . . 0.9 112.047 -178.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.48 -16.02 62.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.998 0.428 . . . . 0.85 111.068 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.77 41.73 95.56 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 121.147 -0.549 . . . . 1.03 113.669 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -120.7 -19.96 7.21 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.955 0.407 . . . . 1.61 110.587 179.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 86.12 27.89 29.76 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 115.89 -0.595 . . . . 0.67 112.578 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.3 m -154.78 142.88 20.24 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 121.365 0.602 . . . . 0.65 110.963 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.518 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 1.4 mt -123.35 113.71 38.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.696 -0.684 . . . . 0.5 109.787 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -87.06 -171.0 3.3 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.455 -0.793 . . . . 1.09 110.285 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.504 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 3.9 m-85 -58.48 -53.4 66.53 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 116.004 -0.544 . . . . 1.78 111.536 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.504 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.6 Cg_endo -55.17 -38.69 93.44 Favored 'Trans proline' 0 C--N 1.361 1.214 0 C-N-CA 122.274 1.982 . . . . 0.79 112.85 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.65 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 38.2 mt-10 -68.38 -44.94 74.05 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.222 0.534 . . . . 0.66 111.154 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -58.2 -29.77 65.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.235 -0.893 . . . . 0.77 112.135 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 80.4 mt -61.82 -27.3 68.67 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-N 116.41 -0.359 . . . . 0.9 111.427 179.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -106.62 -26.92 11.15 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.894 -0.322 . . . . 1.02 111.215 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.615 ' HG3' ' SD ' ' A' ' 72' ' ' MET . 10.5 tpt -49.82 -52.02 35.42 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.298 0.481 . . . . 0.69 112.298 -179.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.615 ' SD ' ' HG3' ' A' ' 71' ' ' MET . 0.3 OUTLIER -94.04 17.65 12.04 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.274 0.472 . . . . 0.99 112.274 -178.83 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -110.39 -41.57 4.34 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.885 0.374 . . . . 1.21 111.21 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -93.9 85.65 4.84 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.917 -0.401 . . . . 2.56 109.917 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -102.64 179.26 4.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.952 0.406 . . . . 3.25 111.488 -179.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 71.7 mtp -82.22 172.96 12.55 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.184 0.516 . . . . 2.59 111.071 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -102.69 -28.57 12.04 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.135 -0.484 . . . . 2.45 110.467 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -63.63 143.62 57.68 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.164 -0.471 . . . . 2.35 110.881 -179.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.6 m -70.01 119.73 14.66 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.999 -0.546 . . . . 3.14 111.088 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.254 1.32 0 CA-C-O 118.448 -0.787 . . . . 3.21 109.874 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . 0.435 HH11 ' HD2' ' B' ' 287' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 110.02 -0.363 . . . . 3.11 110.02 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.795 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -58.58 -24.15 60.23 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-O 120.99 0.424 . . . . 0.6 110.517 178.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . 0.57 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -68.97 -14.54 63.1 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 115.733 -0.667 . . . . 0.65 111.002 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . 0.4 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 6.5 m120 -96.14 -39.88 9.48 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 109.092 -0.707 . . . . 0.87 109.092 175.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . 0.78 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 1.2 mp -64.53 -42.54 95.69 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 115.212 -0.903 . . . . 1.37 109.385 178.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.575 ' CZ3' HD12 ' A' ' 27' ' ' ILE . 4.4 m0 -56.56 -57.28 24.49 Favored Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 108.307 -0.998 . . . . 0.42 108.307 177.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.57 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 7.0 Cg_exo -50.06 -24.71 11.41 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.844 2.362 . . . . 0.54 113.759 175.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.499 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 50.6 m -60.44 -68.39 0.79 Allowed Pre-proline 0 CA--C 1.544 0.715 0 CA-C-O 118.484 -0.769 . . . . 0.95 109.585 178.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.78 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 69.6 Cg_exo -48.88 -38.32 38.09 Favored 'Trans proline' 0 C--N 1.371 1.72 0 C-N-CA 121.88 1.72 . . . . 0.54 112.629 175.094 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.516 ' O ' ' HG3' ' B' ' 300' ' ' ARG . 19.6 tp -61.39 -37.93 85.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.161 -0.472 . . . . 0.56 110.011 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 6.2 ttt -67.16 -39.69 86.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.818 -0.628 . . . . 1.79 109.46 178.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 43.6 mm -64.73 -39.63 86.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.646 0.736 . . . . 0.5 109.057 178.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . 0.523 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.1 OUTLIER -62.68 -40.84 98.36 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.905 -1.043 . . . . 0.51 109.119 178.011 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . 0.516 ' HG3' ' O ' ' B' ' 296' ' ' LEU . 30.3 mtp180 -63.29 -44.79 94.05 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.734 -0.666 . . . . 2.44 109.898 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 50.7 m -59.95 -37.83 80.69 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.71 -0.677 . . . . 0.66 110.109 178.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.2 tptp -73.25 -38.31 66.03 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 110.09 -0.337 . . . . 2.44 110.09 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -64.83 -28.48 69.58 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.603 0.716 . . . . 0.82 109.638 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -81.46 -30.99 33.2 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.142 -0.935 . . . . 1.16 109.636 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 13.0 m . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.304 -0.855 . . . . 1.39 112.294 179.112 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' ' CA' . . . . . 0.662 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' ' CA' . . . . . 0.65 'CA ' ' OE1' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.465 ' HB3' ' OE1' ' A' ' 3' ' ' GLN . . . . . . . . 0 N--CA 1.486 1.353 0 N-CA-C 110.006 -0.368 . . . . 2.58 110.006 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -79.02 86.41 4.88 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-O 121.33 0.586 . . . . 3.47 109.879 178.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.465 ' OE1' ' HB3' ' A' ' 1' ' ' ALA . 6.1 mp0 -124.97 -65.62 1.02 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.564 -0.744 . . . . 2.95 109.29 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 mt -105.73 67.34 0.75 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.66 -0.7 . . . . 1.97 110.117 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.8 -76.65 0.16 Allowed 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.22 -0.9 . . . . 1.68 109.686 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 38.13 69.26 0.26 Allowed 'General case' 0 CA--C 1.532 0.251 0 O-C-N 124.306 1.004 . . . . 1.44 112.658 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.88 -56.37 1.19 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.944 -0.571 . . . . 1.35 110.699 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -79.5 -41.67 26.92 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.232 -0.655 . . . . 1.61 109.232 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.429 ' H ' HG13 ' A' ' 9' ' ' ILE . 5.7 mt -57.45 -24.7 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 114.785 -1.098 . . . . 1.23 111.926 -179.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.07 -31.44 72.66 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 120.791 0.329 . . . . 0.98 111.58 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.91 -21.58 29.62 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.04 0.448 . . . . 1.18 110.475 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -76.51 -32.08 58.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.98 -0.555 . . . . 1.27 110.032 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -72.09 -15.45 62.01 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.171 0.51 . . . . 0.99 110.679 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.417 ' HG3' ' CD1' ' A' ' 18' ' ' LEU . 3.0 tp10 -72.45 -26.05 61.68 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.907 -0.588 . . . . 1.29 110.386 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.588 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -66.73 -43.09 85.12 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.163 -0.471 . . . . 0.58 110.78 -178.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -80.65 5.32 15.89 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.367 -0.379 . . . . 0.98 110.871 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.3 m -112.74 -41.28 3.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.73 112.075 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.634 HD12 ' HG2' ' B' ' 299' ' ' LYS . 18.2 mt -103.49 -44.15 5.2 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.438 0.532 . . . . 0.55 112.438 -178.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.588 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 83.1 t80 -62.59 -34.23 76.58 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.247 0.546 . . . . 0.79 110.435 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.652 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 35.0 t70 -93.95 138.63 31.86 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.688 -0.687 . . . . 0.59 110.139 178.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -124.52 32.62 5.43 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.257 -0.277 . . . . 1.57 110.989 -179.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.622 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 0.1 OUTLIER -131.61 -31.14 1.59 Allowed 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.641 -0.424 . . . . 0.82 111.195 -179.207 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.73 18.65 17.6 Favored Glycine 0 CA--C 1.505 -0.562 0 N-CA-C 111.045 -0.822 . . . . 0.87 111.045 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -97.36 -32.17 12.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.294 -0.453 . . . . 0.74 110.596 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 69.13 31.6 72.2 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 120.922 -0.656 . . . . 1.3 113.707 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.82 138.07 53.29 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 117.909 0.854 . . . . 0.66 110.675 179.17 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 28.6 mt -81.8 111.46 18.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-O 121.089 0.471 . . . . 0.5 111.219 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -128.11 170.18 13.23 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.353 -0.84 . . . . 0.77 109.319 178.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.84 -31.74 59.8 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.18 0.514 . . . . 0.59 112.217 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.2 tttt -62.11 -45.53 93.06 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.273 0.559 . . . . 0.56 112.212 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.665 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 39.5 mp0 -79.22 -20.95 47.0 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.896 -0.593 . . . . 0.87 111.162 -178.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.414 HD21 ' CE ' ' A' ' 51' ' ' MET . 23.5 tp -80.0 -47.39 15.01 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.428 -0.806 . . . . 0.47 110.602 -179.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.14 -37.12 72.34 Favored Glycine 0 CA--C 1.512 -0.145 0 CA-C-N 115.429 -0.805 . . . . 0.36 113.289 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 p -57.12 -28.1 62.39 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.983 0.392 . . . . 0.47 111.89 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 93.5 t -77.07 -56.28 8.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 120.881 -0.328 . . . . 1.38 110.616 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 51.3 mtt -57.69 -37.72 73.95 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.447 -0.342 . . . . 0.85 110.872 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -55.12 -42.18 72.64 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.755 -0.657 . . . . 1.95 111.366 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.8 m -89.58 -19.48 24.92 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.842 0.354 . . . . 0.59 111.786 -178.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.3 tp -79.9 -36.87 35.82 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 112.14 0.422 . . . . 0.72 112.14 -179.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.13 43.81 0.14 Allowed Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.702 -0.761 . . . . 0.56 112.454 -178.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 70.85 147.49 0.07 Allowed 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.77 0.795 . . . . 2.83 111.936 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -102.64 134.8 19.69 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.644 -0.707 . . . . 0.96 109.819 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.7 -161.2 0.11 Allowed 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.475 2.117 . . . . 0.61 112.514 179.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.5 p -76.43 162.16 28.08 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.535 -0.302 . . . . 0.8 110.319 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.431 ' CD ' ' H ' ' A' ' 45' ' ' GLU . 2.9 mp0 -61.92 -31.03 71.31 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 116.676 -0.238 . . . . 2.13 111.199 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.72 -49.21 77.37 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.144 0.497 . . . . 0.7 110.312 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -66.52 -35.12 79.47 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.054 -0.521 . . . . 0.81 110.877 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 21.2 tp -71.61 -34.54 69.94 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.642 -0.708 . . . . 0.76 111.217 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.404 ' O ' HG22 ' A' ' 52' ' ' ILE . 21.4 tt0 -71.55 -39.28 70.78 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.697 -0.483 . . . . 1.12 109.697 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -60.04 -32.38 70.85 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.562 -0.745 . . . . 1.42 109.909 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.414 ' CE ' HD21 ' A' ' 32' ' ' LEU . 1.8 mmm -62.22 -45.98 90.94 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.196 -0.911 . . . . 0.54 110.66 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.638 ' HA ' HG12 ' A' ' 55' ' ' VAL . 6.1 tp -75.98 -18.49 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 C-N-CA 120.71 -0.396 . . . . 0.59 111.41 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -78.96 -20.09 50.05 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.298 0.571 . . . . 1.06 110.269 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.502 ' OE1' ' HA ' ' B' ' 287' ' ' ARG . 14.4 tt0 -99.08 9.5 43.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.564 -0.744 . . . . 1.58 111.706 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.769 ' HB ' ' CB ' ' B' ' 288' ' ' ALA . 9.5 p -137.6 -13.07 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-O 121.227 0.537 . . . . 0.82 112.34 -176.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.604 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 26.9 t70 -109.49 98.48 7.86 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.74 -0.837 . . . . 0.7 108.74 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.0 -22.18 61.46 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 115.957 -0.565 . . . . 0.9 111.936 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.42 -24.28 57.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.155 0.502 . . . . 0.85 110.529 178.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 75.8 29.04 59.87 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.926 -0.654 . . . . 1.03 113.219 178.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -108.05 -22.17 12.51 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.137 -0.69 . . . . 1.61 109.137 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.99 -2.71 64.14 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.846 -0.693 . . . . 0.67 113.526 178.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.3 m -128.13 153.51 46.78 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-O 121.289 0.566 . . . . 0.65 111.526 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.612 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.5 OUTLIER -132.57 122.76 48.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.628 -0.715 . . . . 0.5 110.317 179.515 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -96.11 -171.17 2.26 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 123.709 0.631 . . . . 1.09 110.503 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.516 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 4.8 m-85 -54.18 -55.09 40.39 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 123.801 0.84 . . . . 1.78 111.422 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 10.1 Cg_endo -53.33 -42.68 63.45 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 122.937 2.425 . . . . 0.79 111.845 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.615 ' OE2' 'CA ' ' A' ' 182' ' ' ' CA' . 23.5 mt-10 -65.47 -48.94 70.95 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.216 -0.902 . . . . 0.66 109.68 178.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -56.67 -43.93 80.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.316 0.579 . . . . 0.77 110.367 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.4 mt -55.56 -31.86 62.52 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.177 -0.92 . . . . 0.9 111.72 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.3 m -94.61 -38.28 10.93 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.921 0.391 . . . . 1.02 111.263 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.437 ' HE1' HG23 ' A' ' 55' ' ' VAL . 12.4 tpt -61.26 -59.24 5.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.992 -0.549 . . . . 0.69 111.937 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.405 ' SD ' ' HG3' ' A' ' 71' ' ' MET . 0.1 OUTLIER -77.93 31.98 0.17 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.4 -0.364 . . . . 0.99 111.437 -179.064 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.407 ' H ' ' C ' ' A' ' 71' ' ' MET . . . -136.69 -22.32 1.25 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.171 -0.468 . . . . 1.21 111.604 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -99.89 98.29 9.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.255 0.55 . . . . 2.56 111.437 -179.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 53.1 pttt -91.52 -178.95 5.24 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.85 -0.614 . . . . 3.25 110.374 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 2.8 tpp -126.63 -174.71 3.2 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 110.123 -0.325 . . . . 2.59 110.123 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -109.6 34.1 3.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.559 0.695 . . . . 2.45 109.538 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -90.1 -167.53 1.87 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.93 -1.032 . . . . 2.35 111.164 -177.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 20.4 m -121.75 123.15 41.16 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.191 0.52 . . . . 3.14 110.623 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.776 -0.63 . . . . 3.21 110.449 -179.555 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . 0.502 ' HA ' ' OE1' ' A' ' 54' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 120.906 0.384 . . . . 3.11 110.146 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.769 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -57.86 -25.01 60.14 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 116.12 -0.491 . . . . 0.6 112.3 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . 0.4 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -69.94 -1.72 10.42 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 113.24 0.83 . . . . 0.65 113.24 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . 0.472 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 7.3 m120 -112.11 -30.77 7.11 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.303 0.573 . . . . 0.87 109.477 176.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' B' ' 291' ' ' LEU . 33.0 mt -80.92 -6.02 58.17 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 114.879 -1.055 . . . . 1.37 109.809 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.612 ' CH2' HD12 ' A' ' 63' ' ' ILE . 1.7 m0 -92.13 -53.23 0.27 Allowed Pre-proline 0 CA--C 1.543 0.7 0 N-CA-C 107.589 -1.263 . . . . 0.42 107.589 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.472 ' HD2' ' C ' ' B' ' 290' ' ' ASN . 13.3 Cg_exo -51.68 -36.3 60.84 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 123.05 2.5 . . . . 0.54 112.921 175.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.493 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 2.7 t -58.98 -61.45 7.79 Favored Pre-proline 0 CA--C 1.548 0.885 0 CA-C-O 119.282 -0.389 . . . . 0.95 111.063 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.493 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 88.4 Cg_exo -53.12 -33.09 62.23 Favored 'Trans proline' 0 C--N 1.358 1.058 0 C-N-CA 122.691 2.261 . . . . 0.54 112.596 178.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 15.5 tp -68.02 -35.37 78.18 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.126 0.489 . . . . 0.56 110.091 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 16.7 ttt -70.34 -38.43 74.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.23 -0.896 . . . . 1.79 108.699 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . 0.407 HG12 ' O ' ' B' ' 294' ' ' SER . 48.9 mm -61.74 -38.37 80.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 108.211 -1.033 . . . . 0.5 108.211 177.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . 0.634 ' HG2' HD12 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -59.99 -39.97 87.56 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.308 -0.627 . . . . 0.51 109.308 177.451 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -64.89 -41.15 95.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.55 -0.75 . . . . 2.44 110.414 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 19.4 m -63.45 -35.88 81.91 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.738 -0.664 . . . . 0.66 109.595 178.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 14.3 tptp -76.28 -30.21 57.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.066 -0.515 . . . . 2.44 109.736 179.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 9.4 tttp -68.71 -34.58 75.88 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.806 -0.812 . . . . 0.82 108.806 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -76.01 -40.34 53.78 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.568 -1.196 . . . . 1.16 110.08 179.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.668 -0.682 . . . . 1.39 111.455 179.575 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' ' CA' . . . . . 0.665 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' ' CA' . . . . . 0.615 'CA ' ' OE2' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.407 ' HB3' ' OE1' ' A' ' 3' ' ' GLN . . . . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 110.049 -0.352 . . . . 2.58 110.049 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -74.01 72.44 1.64 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.333 0.587 . . . . 3.47 110.85 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.407 ' OE1' ' HB3' ' A' ' 1' ' ' ALA . 2.2 mp0 -106.6 -43.84 4.63 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.518 -0.765 . . . . 2.95 110.283 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.2 mt -112.44 77.31 1.03 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.575 -0.738 . . . . 1.97 110.987 -178.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.13 -53.38 4.14 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.987 -0.551 . . . . 1.68 110.579 179.563 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 54.81 63.54 2.11 Favored 'General case' 0 C--O 1.224 -0.248 0 O-C-N 123.715 0.635 . . . . 1.44 111.145 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.92 -55.45 2.49 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.641 -0.424 . . . . 1.35 111.626 -178.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -94.27 -24.58 17.39 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.062 0.458 . . . . 1.61 109.953 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.428 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 6.5 mt -65.18 -23.05 32.42 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-N 115.95 -0.568 . . . . 1.23 110.581 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.61 -26.55 64.5 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.871 -0.332 . . . . 0.98 111.268 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -92.76 -12.69 30.63 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 120.866 0.365 . . . . 1.18 111.32 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -80.46 -37.54 31.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.145 0.498 . . . . 1.27 109.802 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 81.8 mttt -61.64 -22.69 65.49 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.507 0.67 . . . . 0.99 111.206 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.504 ' CG ' ' HE3' ' B' ' 299' ' ' LYS . 1.3 tp10 -70.88 -22.0 62.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.387 -0.824 . . . . 1.29 112.076 -177.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.697 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -70.18 -36.31 74.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.181 0.515 . . . . 0.58 110.647 179.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.422 ' HB3' ' HA3' ' A' ' 25' ' ' GLY . 10.5 m-85 -86.19 16.55 4.25 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.022 -0.535 . . . . 0.98 109.665 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.6 m -125.56 -56.58 1.49 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.886 -0.597 . . . . 0.73 112.202 -178.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.494 ' HB2' ' CG ' ' B' ' 299' ' ' LYS . 13.6 mt -96.1 -30.56 13.47 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.255 0.465 . . . . 0.55 112.255 -178.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.697 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 46.5 t80 -73.92 -34.03 64.2 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.062 0.458 . . . . 0.79 110.096 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.646 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 24.2 t70 -91.22 140.69 29.56 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.685 -0.689 . . . . 0.59 109.605 179.248 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -114.74 6.55 15.63 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.579 0.585 . . . . 1.57 112.579 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.639 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 0.0 OUTLIER -104.62 -53.86 2.62 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.419 -0.512 . . . . 0.82 110.942 -178.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 139.44 4.38 1.46 Allowed Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.827 -0.701 . . . . 0.87 112.34 -178.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.93 -58.15 2.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.974 0.416 . . . . 0.74 110.017 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.422 ' HA3' ' HB3' ' A' ' 16' ' ' PHE . . . 111.84 -29.95 8.13 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.798 -0.637 . . . . 1.3 111.556 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.85 130.22 40.28 Favored 'General case' 0 C--N 1.323 -0.549 0 O-C-N 123.925 0.427 . . . . 0.66 111.859 -179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.579 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 24.1 mt -78.79 108.45 12.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 116.107 -0.497 . . . . 0.5 110.615 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.91 170.9 9.34 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 108.49 -0.93 . . . . 0.77 108.49 177.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.473 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -57.58 -31.69 66.42 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 111.679 0.252 . . . . 0.59 111.679 -179.54 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.9 tttt -63.8 -44.96 91.76 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.066 0.395 . . . . 0.56 112.066 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.666 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 25.2 mp0 -79.97 -21.81 43.31 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 111.742 0.275 . . . . 0.87 111.742 -178.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.605 HD21 ' HE2' ' A' ' 51' ' ' MET . 18.1 tp -79.53 -46.62 17.01 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.083 -0.508 . . . . 0.47 110.77 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.82 -36.32 86.74 Favored Glycine 0 N--CA 1.453 -0.212 0 CA-C-N 115.851 -0.613 . . . . 0.36 113.104 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.71 -31.05 67.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.771 0.286 . . . . 0.47 111.351 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 67.0 t -73.23 -56.55 9.18 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 N-CA-C 109.265 -0.643 . . . . 1.38 109.265 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 59.9 mtt -52.15 -46.9 65.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.121 -0.945 . . . . 0.85 111.134 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -57.28 -38.02 73.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.433 -0.803 . . . . 1.95 111.3 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.0 m -95.41 14.18 23.42 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.102 -0.499 . . . . 0.59 111.671 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.8 tp -122.03 -43.1 2.35 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.536 0.208 . . . . 0.72 110.916 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -164.24 49.93 0.29 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.618 -0.801 . . . . 0.56 112.599 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 72.35 146.07 0.08 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.517 0.727 . . . . 2.83 111.707 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -87.2 140.55 32.44 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.453 -0.794 . . . . 0.96 109.88 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -77.91 -172.96 1.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.271 1.981 . . . . 0.61 111.388 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.7 p -81.76 160.33 23.63 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.935 -0.765 . . . . 0.8 108.935 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -55.16 -32.92 62.52 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.059 0.392 . . . . 2.13 112.059 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.41 -52.34 58.68 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.224 -0.444 . . . . 0.7 110.829 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -64.01 -34.03 77.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.439 . . . . 0.81 110.839 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.473 ' HG ' HG22 ' A' ' 29' ' ' THR . 15.3 tp -63.73 -47.15 82.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.256 -0.429 . . . . 0.76 110.346 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -69.97 -33.39 72.02 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 116.353 -0.385 . . . . 1.12 111.459 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -71.78 -26.8 62.58 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.318 0.58 . . . . 1.42 110.157 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.605 ' HE2' HD21 ' A' ' 32' ' ' LEU . 1.8 mmm -61.95 -42.25 98.9 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.462 -0.79 . . . . 0.54 110.859 178.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.471 ' HA ' HG12 ' A' ' 55' ' ' VAL . 5.4 tp -76.87 -14.67 14.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-O 121.164 0.507 . . . . 0.59 110.278 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.5 t30 -78.37 -22.15 48.35 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.686 0.755 . . . . 1.06 109.054 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.622 ' OE2' ' HA ' ' B' ' 287' ' ' ARG . 2.4 tt0 -98.25 22.52 9.47 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.417 -0.811 . . . . 1.58 111.047 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.741 ' HB ' ' CB ' ' B' ' 288' ' ' ALA . 9.1 p -154.07 -36.65 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.205 0 N-CA-C 113.627 0.973 . . . . 0.82 113.627 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.629 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 28.9 t70 -89.77 91.18 8.53 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.243 -0.583 . . . . 0.7 109.524 179.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.36 -24.91 67.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.197 -0.91 . . . . 0.9 113.364 -178.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -75.58 -10.95 59.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.93 0.395 . . . . 0.85 110.66 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.08 48.59 68.98 Favored Glycine 0 CA--C 1.519 0.312 0 CA-C-N 116.077 -0.51 . . . . 1.03 114.128 178.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -128.87 -27.79 2.5 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.198 0.523 . . . . 1.61 110.027 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.73 17.88 36.97 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.78 -0.645 . . . . 0.67 113.2 178.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 2.0 m -141.75 139.99 32.98 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.886 0.343 . . . . 0.65 110.808 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.669 HD12 ' CH2' ' B' ' 292' ' ' TRP . 0.9 OUTLIER -124.56 118.92 54.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.119 0.485 . . . . 0.5 111.202 179.879 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -93.01 -167.14 1.67 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.368 -0.833 . . . . 1.09 110.472 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.48 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 28.3 m-85 -57.97 -53.32 67.0 Favored Pre-proline 0 CA--C 1.54 0.592 0 C-N-CA 122.936 0.494 . . . . 1.78 112.292 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.3 Cg_endo -57.53 -36.44 98.66 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.991 1.794 . . . . 0.79 112.026 179.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.638 ' OE2' 'CA ' ' A' ' 182' ' ' ' CA' . 31.1 mt-10 -72.14 -39.48 68.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.526 -0.761 . . . . 0.66 110.943 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -66.12 -37.47 85.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.245 -0.434 . . . . 0.77 109.835 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.606 ' O ' ' HB3' ' A' ' 73' ' ' ALA . 35.8 mt -63.71 -32.64 74.2 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.817 -0.629 . . . . 0.9 110.286 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.5 m -92.31 11.07 27.13 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.95 -0.568 . . . . 1.02 110.644 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.7 tpt -119.15 -68.25 0.93 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.369 -0.378 . . . . 0.69 111.181 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -17.68 63.39 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.735 0.303 . . . . 0.99 111.727 -178.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.606 ' HB3' ' O ' ' A' ' 69' ' ' LEU . . . -104.06 9.47 36.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.918 0.39 . . . . 1.21 110.459 179.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -128.88 37.52 4.07 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.27 -0.423 . . . . 2.56 111.833 -178.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -67.3 157.74 33.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.075 0.464 . . . . 3.25 110.379 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 2.6 mpp? -93.33 156.03 17.05 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.118 -0.492 . . . . 2.59 111.89 -178.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 31.6 mttt -84.89 63.06 7.84 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.89 -0.595 . . . . 2.45 110.211 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -114.44 -164.75 0.95 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.427 -0.806 . . . . 2.35 109.54 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.72 90.54 5.02 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 120.975 0.417 . . . . 3.14 110.687 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.764 -0.636 . . . . 3.21 111.042 -179.878 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . 0.622 ' HA ' ' OE2' ' A' ' 54' ' ' GLU . 1.7 tpm_? . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 109.441 -0.578 . . . . 3.11 109.441 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.741 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -61.4 -28.16 69.05 Favored 'General case' 0 C--O 1.214 -0.815 0 N-CA-C 113.295 0.85 . . . . 0.6 113.295 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . 0.548 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -70.59 1.3 5.36 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.03 0.752 . . . . 0.65 113.03 -179.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -115.95 -37.28 3.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 122.847 1.308 . . . . 0.87 109.431 176.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . . . . . . . . . 25.6 mt -80.52 -7.14 59.09 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 113.245 -1.798 . . . . 1.37 110.662 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.682 ' CE2' HG21 ' A' ' 55' ' ' VAL . 5.0 m0 -93.81 -53.88 0.24 Allowed Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 107.355 -1.35 . . . . 0.42 107.355 174.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.548 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 21.5 Cg_exo -50.94 -37.11 55.58 Favored 'Trans proline' 0 C--N 1.367 1.508 0 C-N-CA 122.578 2.185 . . . . 0.54 113.029 175.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . . . . . . . . . 1.4 t -59.67 -60.82 9.34 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-O 119.34 -0.362 . . . . 0.95 110.346 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.407 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 85.2 Cg_exo -51.14 -38.4 60.36 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 122.203 1.935 . . . . 0.54 112.091 176.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 9.5 tp -64.65 -36.73 85.21 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.824 0.345 . . . . 0.56 110.345 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 17.5 ttt -66.43 -41.66 88.87 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.499 0.666 . . . . 1.79 109.285 177.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 20.4 mm -62.93 -35.6 72.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 108.447 -0.946 . . . . 0.5 108.447 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . 0.504 ' HE3' ' CG ' ' A' ' 14' ' ' GLU . 0.2 OUTLIER -66.35 -40.86 90.08 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.88 -1.054 . . . . 0.51 109.381 178.08 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 73.1 mtt180 -63.34 -40.01 96.11 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.198 -0.455 . . . . 2.44 110.101 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 66.2 m -64.71 -42.78 95.01 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.842 -0.617 . . . . 0.66 109.782 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -69.06 -36.9 78.18 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.119 -0.491 . . . . 2.44 110.561 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 3.3 tttp -63.81 -33.08 74.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.815 0.817 . . . . 0.82 109.197 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -81.61 -21.76 38.1 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.699 -1.137 . . . . 1.16 110.81 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.251 1.161 0 CA-C-O 118.575 -0.726 . . . . 1.39 110.265 179.083 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' ' CA' . . . . . 0.666 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' ' CA' . . . . . 0.638 'CA ' ' OE2' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.183 0 N-CA-C 110.51 -0.182 . . . . 2.58 110.51 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -78.06 57.8 1.86 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.062 0.458 . . . . 3.47 111.568 -178.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 -104.31 -41.52 5.75 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.559 0.695 . . . . 2.95 109.206 178.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 34.2 mt -100.8 60.95 0.97 Allowed 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 114.863 -1.062 . . . . 1.97 109.431 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.492 ' HB ' ' H ' ' A' ' 6' ' ' GLU . 1.3 m -70.76 -93.39 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.105 -0.952 . . . . 1.68 111.643 -179.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.492 ' H ' ' HB ' ' A' ' 5' ' ' THR . 50.3 mm-40 42.29 56.19 3.75 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.177 0.806 . . . . 1.44 113.177 179.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.12 -49.24 2.79 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.834 0.349 . . . . 1.35 111.188 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -104.36 -26.28 12.51 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 109.68 -0.489 . . . . 1.61 109.68 179.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mt -57.32 -27.73 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 115.491 -0.777 . . . . 1.23 110.373 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.24 -42.07 99.17 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.528 -0.76 . . . . 0.98 110.936 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -77.6 -17.27 57.97 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.168 -0.469 . . . . 1.18 111.265 -178.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -82.45 -38.4 24.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 1.27 110.445 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.419 ' HA ' ' CE2' ' A' ' 16' ' ' PHE . 38.2 mtmt -69.62 -13.9 62.55 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.372 0.606 . . . . 0.99 110.335 179.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -73.19 -17.06 61.4 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.277 -0.874 . . . . 1.29 110.696 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.638 ' O ' ' HB3' ' A' ' 19' ' ' PHE . . . -69.9 -32.82 71.34 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.341 0.591 . . . . 0.58 110.377 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.419 ' CE2' ' HA ' ' A' ' 13' ' ' LYS . 12.6 m-85 -79.92 5.33 14.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.856 -0.611 . . . . 0.98 111.505 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -124.94 -47.56 1.79 Allowed 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 121.049 -0.261 . . . . 0.73 110.99 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.417 ' HB2' ' CG ' ' B' ' 299' ' ' LYS . 35.8 mt -93.22 -38.96 11.27 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 111.866 0.321 . . . . 0.55 111.866 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.638 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 92.0 t80 -74.4 -42.15 59.73 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.861 0.362 . . . . 0.79 110.898 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -87.31 136.56 32.89 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.286 -0.416 . . . . 0.59 110.671 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -106.35 -11.63 15.92 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.145 0.424 . . . . 1.57 112.145 -178.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.628 ' OD2' 'CA ' ' A' ' 181' ' ' ' CA' . 0.0 OUTLIER -90.87 -40.76 11.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.155 0.502 . . . . 0.82 110.655 -179.114 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.07 16.72 15.82 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 110.922 -0.871 . . . . 0.87 110.922 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.656 ' OD1' 'CA ' ' A' ' 181' ' ' ' CA' . 5.0 p-10 -96.86 -21.42 17.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.892 0.377 . . . . 0.74 111.02 -179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.8 -46.11 3.41 Favored Glycine 0 C--O 1.227 -0.291 0 C-N-CA 121.085 -0.579 . . . . 1.3 114.269 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.39 129.84 29.64 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 117.046 0.423 . . . . 0.66 111.622 -179.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.405 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 54.4 mt -83.73 115.79 26.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-O 121.362 0.601 . . . . 0.5 111.838 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -126.49 171.86 10.7 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 114.884 -1.053 . . . . 0.77 109.861 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.509 HG22 ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -57.09 -27.68 61.97 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.742 0.645 . . . . 0.59 112.742 179.405 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -68.1 -39.09 82.91 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.173 0.435 . . . . 0.56 112.173 -178.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.663 ' OE2' 'CA ' ' A' ' 181' ' ' ' CA' . 20.1 mp0 -84.92 -19.22 32.56 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 121.957 -0.464 . . . . 0.87 110.96 -178.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.474 HD21 ' CE ' ' A' ' 51' ' ' MET . 20.4 tp -79.13 -41.2 29.1 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.894 -0.594 . . . . 0.47 110.237 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.33 -28.46 55.68 Favored Glycine 0 C--O 1.226 -0.372 0 C-N-CA 120.946 -0.645 . . . . 0.36 113.843 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.83 -25.66 68.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 117.419 0.61 . . . . 0.47 111.288 -179.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.2 t -80.31 -55.69 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 N-CA-C 109.573 -0.528 . . . . 1.38 109.573 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 33.7 mtt -54.47 -39.62 67.65 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.149 0.499 . . . . 0.85 111.035 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -62.4 -38.44 89.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.576 -0.738 . . . . 1.95 111.867 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.2 m -93.12 2.45 56.71 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.078 0.466 . . . . 0.59 111.796 -177.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.0 tp -109.35 -57.91 2.1 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.835 -0.621 . . . . 0.72 110.773 -179.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -145.8 44.61 0.85 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 119.988 -1.101 . . . . 0.56 113.323 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 73.08 140.62 0.06 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.68 0.752 . . . . 2.83 111.834 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -81.68 138.05 47.43 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.384 -0.825 . . . . 0.96 110.496 -179.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.72 -165.55 0.3 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.804 2.336 . . . . 0.61 112.862 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 68.6 p -79.3 161.82 26.02 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.949 -0.389 . . . . 0.8 109.949 178.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -59.27 -36.95 76.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.788 0.327 . . . . 2.13 110.483 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.3 -47.13 80.66 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.408 -0.36 . . . . 0.7 110.175 179.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -63.25 -40.95 98.85 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.119 0.485 . . . . 0.81 110.282 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.509 ' HG ' HG22 ' A' ' 29' ' ' THR . 55.3 tp -59.03 -43.6 91.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.444 -0.798 . . . . 0.76 111.072 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.508 ' O ' HG22 ' A' ' 52' ' ' ILE . 19.1 tt0 -75.74 -35.06 60.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.044 -0.525 . . . . 1.12 111.665 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -68.04 -25.42 65.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.925 0.393 . . . . 1.42 110.844 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.509 ' O ' HG12 ' A' ' 55' ' ' VAL . 1.9 mmm -64.37 -44.96 89.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.364 -0.38 . . . . 0.54 110.068 179.498 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.517 ' HA ' ' CG1' ' A' ' 55' ' ' VAL . 6.9 tp -70.92 -21.35 22.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.077 0.465 . . . . 0.59 109.976 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -78.21 -17.73 56.36 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.994 -0.743 . . . . 1.06 108.994 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.521 ' HG3' ' H ' ' B' ' 288' ' ' ALA . 19.3 tp10 -95.81 -0.67 50.91 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.418 -0.81 . . . . 1.58 111.239 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.713 HG21 ' CE2' ' B' ' 292' ' ' TRP . 1.0 OUTLIER -122.22 -46.27 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 N-CA-C 112.177 0.436 . . . . 0.82 112.177 -179.756 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.638 ' OD1' 'CA ' ' A' ' 182' ' ' ' CA' . 13.6 t70 -76.52 99.75 5.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.41 0.624 . . . . 0.7 111.288 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.71 -22.62 46.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.182 -0.917 . . . . 0.9 111.425 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -76.56 -0.78 24.44 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.194 -0.457 . . . . 0.85 111.967 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.97 46.37 84.45 Favored Glycine 0 C--O 1.224 -0.487 0 C-N-CA 121.554 -0.355 . . . . 1.03 113.977 178.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -127.46 -17.66 4.6 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.419 0.628 . . . . 1.61 109.697 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 76.64 24.08 68.43 Favored Glycine 0 N--CA 1.452 -0.238 0 CA-C-N 115.537 -0.756 . . . . 0.67 112.921 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.0 m -151.75 146.71 25.94 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.938 0.399 . . . . 0.65 110.552 179.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.479 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 0.9 OUTLIER -123.93 109.07 22.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.283 0.564 . . . . 0.5 110.023 179.12 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -78.81 -176.65 5.07 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.296 -0.866 . . . . 1.09 110.062 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.493 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 74.8 m-85 -57.72 -53.63 63.66 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 116.262 -0.426 . . . . 1.78 111.309 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 10.5 Cg_endo -56.23 -35.72 95.87 Favored 'Trans proline' 0 C--N 1.357 0.976 0 C-N-CA 122.497 2.131 . . . . 0.79 112.138 178.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.624 ' OE1' 'CA ' ' A' ' 182' ' ' ' CA' . 36.9 mt-10 -69.45 -39.21 77.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.164 -0.471 . . . . 0.66 110.047 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -59.66 -39.22 83.71 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.57 -0.741 . . . . 0.77 111.239 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 94.4 mt -64.29 -36.6 84.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.249 0.547 . . . . 0.9 110.599 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.6 m -80.41 -39.6 28.03 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.702 -0.681 . . . . 1.02 111.333 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 7.3 tpt -62.69 -54.45 39.21 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.85 -0.614 . . . . 0.69 112.056 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -4.61 30.24 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.708 0.632 . . . . 0.99 112.708 -177.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -101.48 2.9 39.74 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.995 0.426 . . . . 1.21 110.287 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.442 HH11 ' HD3' ' A' ' 74' ' ' ARG . 0.1 OUTLIER -124.88 78.3 1.68 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.038 -0.528 . . . . 2.56 111.051 -179.209 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.402 ' H ' ' HG2' ' A' ' 75' ' ' LYS . 16.5 pttm -86.21 169.65 12.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.841 0.353 . . . . 3.25 110.649 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 33.3 mtp -92.59 157.08 16.7 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.91 -0.586 . . . . 2.59 111.346 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -101.75 14.3 32.35 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.21 0.529 . . . . 2.45 111.386 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -92.42 171.39 9.07 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.124 -0.489 . . . . 2.35 110.346 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -74.32 122.68 23.28 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 110.081 -0.34 . . . . 3.14 110.081 179.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.143 0 CA-C-O 119.224 -0.417 . . . . 3.21 110.861 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . 0.421 ' HB3' ' OD1' ' B' ' 290' ' ' ASN . 4.4 ttm180 . . . . . 0 N--CA 1.477 0.91 0 N-CA-C 109.858 -0.423 . . . . 3.11 109.858 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.579 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -67.26 -20.44 65.66 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 112.568 0.581 . . . . 0.6 112.568 -178.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . 0.573 ' O ' ' HG2' ' B' ' 293' ' ' PRO . . . -72.06 -3.49 23.31 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-O 121.356 0.598 . . . . 0.65 112.111 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . 0.421 ' OD1' ' HB3' ' B' ' 287' ' ' ARG . 3.2 m120 -111.86 -33.76 6.21 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 122.578 1.18 . . . . 0.87 109.893 175.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . 0.415 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 8.1 mp -79.74 -13.11 59.68 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 114.267 -1.333 . . . . 1.37 110.283 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.713 ' CE2' HG21 ' A' ' 55' ' ' VAL . 3.4 m0 -86.88 -54.65 0.38 Allowed Pre-proline 0 CA--C 1.531 0.222 0 N-CA-C 107.385 -1.339 . . . . 0.42 107.385 175.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.573 ' HG2' ' O ' ' B' ' 289' ' ' ALA . 18.3 Cg_exo -49.23 -33.21 27.45 Favored 'Trans proline' 0 C--N 1.366 1.465 0 C-N-CA 122.631 2.221 . . . . 0.54 112.812 174.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.586 ' HB3' ' HD3' ' B' ' 295' ' ' PRO . 13.7 t -58.22 -63.43 3.96 Favored Pre-proline 0 CA--C 1.547 0.837 0 CA-C-O 118.999 -0.524 . . . . 0.95 110.847 179.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.586 ' HD3' ' HB3' ' B' ' 294' ' ' SER . 76.1 Cg_exo -52.22 -35.82 64.86 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 122.243 1.962 . . . . 0.54 112.236 176.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 18.7 tp -69.09 -31.42 70.13 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.054 0.454 . . . . 0.56 109.782 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . 0.404 ' O ' ' HB2' ' B' ' 300' ' ' ARG . 15.5 ttt -71.73 -42.55 67.15 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.175 -1.046 . . . . 1.79 108.175 178.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 42.0 mm -62.74 -33.14 58.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 107.94 -1.133 . . . . 0.5 107.94 176.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . 0.454 ' HE2' ' C ' ' B' ' 299' ' ' LYS . 0.1 OUTLIER -64.31 -36.92 85.69 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 108.66 -0.867 . . . . 0.51 108.66 177.664 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . 0.404 ' HB2' ' O ' ' B' ' 297' ' ' MET . 44.5 mtt180 -66.7 -36.24 82.02 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.742 -0.836 . . . . 2.44 108.742 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 12.8 m -66.9 -38.33 86.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.973 -1.012 . . . . 0.66 109.275 178.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.45 -35.41 65.75 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.105 -0.702 . . . . 2.44 109.105 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -66.72 -36.06 81.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.399 0.619 . . . . 0.82 109.439 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -72.17 -39.92 68.32 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.197 -0.91 . . . . 1.16 109.145 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 8.4 m . . . . . 0 C--O 1.252 1.2 0 CA-C-O 118.239 -0.886 . . . . 1.39 110.149 179.356 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' ' CA' . . . . . 0.663 'CA ' ' OE2' ' A' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' ' CA' . . . . . 0.638 'CA ' ' OD1' ' A' ' 56' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_